SCHEMBL3198697

SCHEMBL3198697

N#Cc1ccc(/C=N/c2ccc(F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA9 Q16790 2/20 0.53
PTGS1 P23219 2/20 0.53
CA12 O43570 1/20 0.53
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 5/20 0.47
GAA P10253 3/20 0.47
LMNA P02545 2/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ADORA2A P29274 2/20 0.44
TP53 P04637 2/20 0.43
ACHE P22303 1/20 0.42
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3190840 1.00 PTGS2 (0.53) PTGS2CA1CA2CA9PTGS1
SCHEMBL3190836 1.00 PTGS2 (0.53) PTGS2CA1CA2CA9PTGS1
SCHEMBL2909491 1.00 PTGS2 (0.53) PTGS2CA1CA2CA9PTGS1
SCHEMBL4787112 0.88 S100B (0.56) PTGS2CA1CA2CA9PTGS1
SCHEMBL4787108 0.88 S100B (0.56) PTGS2CA1CA2CA9PTGS1
SCHEMBL20186948 0.84 PTGS2 (0.67) PTGS2CA1CA2CA9PTGS1
SCHEMBL12416601 0.84 PTGS2 (0.67) PTGS2CA1CA2CA9PTGS1
SCHEMBL2455348 0.84 PTGS2 (0.67) PTGS2CA1CA2CA9PTGS1
SCHEMBL2455350 0.84 PTGS2 (0.67) PTGS2CA1CA2CA9PTGS1
SCHEMBL12416606 0.84 PTGS2 (0.67) PTGS2CA1CA2CA9PTGS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160282-A1 NOVEL DIPHENYLAZETIDINONES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS COMPRISING THESE COMPOUNDS AND THEIR USE SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-06-24 US disclosed
US-7674773-B2 Diphenylazetidinones, process for their preparation, medicaments comprising these compounds and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-03-09 US disclosed
US-7671047-B2 Cationically substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-03-02 US disclosed
US-7579339-B2 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-08-25 US disclosed
US-7407938-B2 1,4-Diphenyl-3-(3-hydroxy-3-phenylpropyl)-2-azetidinones, e.g., 2,3,4,5,6-Pentahydroxyhexylamide of 4-(4-{4-[3-[3-(4-fluorophenyl)-3-hydroxypropyl]-2-(4-methoxyphenyl)-4-oxoazetidin-1-y]lbenzylcarbamoyl}phenoxy)benzoic acid; antilipemic agents that have intestinal absorption of less than 10%, SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-08-05 US disclosed
US-7390790-B2 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-06-24 US disclosed
US-7388004-B2 Acid-group-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-06-17 US disclosed
US-20070123506-A1 Acid-group-substituted diphenylazetidinones process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH 2007-05-31 US disclosed
US-20070043017-A1 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH 2007-02-22 US disclosed
US-20070037787-A1 1,4-Diphenyl-3-(3-hydroxy-3-phenylpropyl)-2-azetidinones, e.g., 2,3,4,5,6-Pentahydroxyhexylamide of 4-(4-{4-[3-[3-(4-fluorophenyl)-3-hydroxypropyl]-2-(4-methoxyphenyl)-4-oxoazetidin-1-y]lbenzylcarbamoyl}phenoxy)benzoic acid; antilipemic agents that have intestinal absorption of less than 10%, SANOFI-AVENTIS DEUTSCHLAND GMBH 2007-02-15 US disclosed
US-7176194-B2 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-02-13 US disclosed
US-20060270613-A1 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH 2006-11-30 US disclosed
US-6992067-B2 Diphenylazetidinones, process for their preparation, medicaments comprising these compounds and their use AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2006-01-31 US disclosed
US-20050267038-A1 Novel diphenylazetidinones, process for their preparation, medicaments comprising these compounds and their use AVENTIS PHARMA DEUTSCHLAND GMBH 2005-12-01 US disclosed
US-20040082561-A1 Ring -substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-04-29 US disclosed
US-20040077623-A1 Cationically substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-04-22 US disclosed
US-20040067913-A1 Acid-group-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-04-08 US disclosed
US-6498156-B2 TREATING HYPERLIPIDEMIA, ARTERIOSCLEROSIS AND HYPERCHOLESTEROLEMIA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-12-24 US disclosed
US-20020137689-A1 Novel diphenylazetidinones, process for their preparation, medicaments comprising these compounds and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-09-26 US disclosed
US-20020128252-A1 Diphenylazetidinone derivatives, process for their preparation, medicaments comprising these compounds and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-09-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070043017-A1 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use QDPR, CYP2D6, DHCR7 PTGS2 982/4885CA1 4601/4885CA2 3214/4885
US-20020137689-A1 Novel diphenylazetidinones, process for their preparation, medicaments comprising these compounds and their use QDPR, NDUFB7, NDUFB6 PTGS2 1532/4885CA1 4868/4885CA2 4405/4885
US-20040082561-A1 Ring -substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use QDPR, CYP2D6, DHCR7 PTGS2 884/4885CA1 4524/4885CA2 3141/4885
US-20060270613-A1 Ring-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use QDPR, CYP2D6, DHCR7 PTGS2 982/4885CA1 4601/4885CA2 3214/4885
US-20040067913-A1 Acid-group-substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use CYP2D6, QDPR, CYP26A1 PTGS2 1099/4885CA1 3225/4885CA2 1578/4885
US-20050267038-A1 Novel diphenylazetidinones, process for their preparation, medicaments comprising these compounds and their use QDPR, NDUFB6, NDUFB7 PTGS2 1626/4885CA1 4873/4885CA2 4428/4885
US-20070037787-A1 1,4-Diphenyl-3-(3-hydroxy-3-phenylpropyl)-2-azetidinones, e.g., 2,3,4,5,6-Pentahydroxyhexylamide of 4-(4-{4-[3-[3-(4-fluorophenyl)-3-hydroxypropyl]-2-(4-methoxyphenyl)-4-oxoazetidin-1-y]lbenzylcarbamoyl}phenoxy)benzoic acid; antilipemic agents that have intestinal absorption of less than 10%, HPD, FABP2, CYP2B6 PTGS2 660/4885CA1 3960/4885CA2 1755/4885
US-20040077623-A1 Cationically substituted diphenylazetidinones, process for their preparation, medicaments comprising these compounds, and their use QDPR, DRD4, CYP2D6 PTGS2 1935/4885CA1 4374/4885CA2 2139/4885
US-20070123506-A1 Acid-group-substituted diphenylazetidinones process for their preparation, medicaments comprising these compounds, and their use CYP2D6, QDPR, CYP2A6 PTGS2 916/4885CA1 3798/4885CA2 1980/4885
US-20100160282-A1 NOVEL DIPHENYLAZETIDINONES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS COMPRISING THESE COMPOUNDS AND THEIR USE QDPR, NDUFB6, NDUFB7 PTGS2 1626/4885CA1 4873/4885CA2 4428/4885
US-20020128252-A1 Diphenylazetidinone derivatives, process for their preparation, medicaments comprising these compounds and their use QDPR, NDUFB6, NDUFB7 PTGS2 1665/4885CA1 4848/4885CA2 4344/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.