SCHEMBL822807

SCHEMBL822807

Cn1c(-c2ccccc2)cnc1-c1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.77
LDLR P01130 1/20 0.65
PCSK9 Q8NBP7 1/20 0.65
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2D6 P10635 1/20 0.63
GAA P10253 5/20 0.56
PDE3B Q13370 1/20 0.55
PDE3A Q14432 1/20 0.55
ATP1A1 P05023 4/20 0.50
ATP1B1 P05026 4/20 0.50
ATP1A3 P13637 4/20 0.50
ATP1B2 P14415 4/20 0.50
ATP1A2 P50993 4/20 0.50
ATP1B3 P54709 4/20 0.50
FXYD2 P54710 4/20 0.50
ATP1A4 Q13733 4/20 0.50
MAP4K4 O95819 1/20 0.50
KMT2A Q03164 2/20 0.47
CYP11B1 P15538 1/20 0.46

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
SCHEMBL24418677 0.88 HPGDS (0.62) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL2365544 0.87 HPGDS (1.00) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL2835874 0.84 HPGDS (0.67) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL12721184 0.83 CYP1A2 (0.63) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL8453399 0.81 HPGDS (0.58) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL11515528 0.80 HPGDS (0.53) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL2837450 0.78 HPGDS (0.76) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL8306426 0.78 HPGDS (0.54) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL3958498 0.78 CYP1A2 (0.61) HPGDSLDLRPCSK9CYP1A2CYP3A4
SCHEMBL532551 0.78 CYP1A2 (1.00) HPGDSLDLRPCSK9CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11839140-B2 Metal complexes comprising diazabenzmidazolocarbene ligands and the use thereof in OLEDS UDC IRELAND LIMITED (IE) 2023-12-05 US disclosed
US-11839140-B2 Metal complexes comprising diazabenzmidazolocarbene ligands and the use thereof in OLEDS UDC IRELAND LIMITED (IE) 2023-12-05 US disclosed
US-20230026258-A1 Metal Complexes Comprising Diazabenzmidazolocarbene Ligands and the Use Thereof in OLEDS UDC IRELAND LTD (IE) 2023-01-26 US disclosed
US-9850268-B2 Metathesis catalysts and methods thereof TRUSTEES OF BOSTON COLLEGE (US) 2017-12-26 US disclosed
US-9701702-B2 Metathesis catalysts and methods thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-07-11 US disclosed
US-20160229877-A1 METATHESIS CATALYSTS AND METHODS THEREOF NATIONAL SCIENCE FOUNDATION 2016-08-11 US disclosed
US-9206211-B2 Metathesis catalysts and methods thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-12-08 US disclosed
US-9067919-B2 Use of dibenzofurans and dibenzothiophenes substituted by nitrogen-bonded five-membered heterocyclic rings in organic electronics BASF SE (DE) 2015-06-30 US disclosed
US-20140316088-A1 METATHESIS CATALYSTS AND METHODS THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-10-23 US disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
US-4164480-A POLYMER STABILIZERS EASTMAN KODAK COMPANY (US) 1979-08-14 US disclosed
US-4105631-A MULTICHROMOPHORIC ULTRAVIOLET STABILIZERS AND THEIR USE IN ORGANIC COMPOSITIONS EASTMAN KODAK COMPANY (US) 1978-08-08 US disclosed
US-4043973-A PIGMENTS, COLORANTS, FILLERS, REINFORCING AGENTS EASTMAN KODAK COMPANY (US) 1977-08-23 US disclosed
US-3939115-A OXADIAZOLES EASTMAN KODAK COMPANY (US) 1976-02-17 US disclosed
US-3936419-A Multichromophoric ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1976-02-03 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 (6 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 HPGDS 4351/4885LDLR 915/4885PCSK9 4873/4885
US-20230026258-A1 Metal Complexes Comprising Diazabenzmidazolocarbene Ligands and the Use Thereof in OLEDS OCIAD1, OCIAD2, DRD2 HPGDS 3245/4885LDLR 1757/4885PCSK9 4362/4885
US-20160229877-A1 METATHESIS CATALYSTS AND METHODS THEREOF CYP51A1, SQLE, MOGAT2 HPGDS 2919/4885LDLR 3465/4885PCSK9 1275/4885
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 HPGDS 4095/4885LDLR 2136/4885PCSK9 4880/4885
US-20140316088-A1 METATHESIS CATALYSTS AND METHODS THEREOF CYP51A1, SQLE, MOGAT2 HPGDS 2919/4885LDLR 3465/4885PCSK9 1275/4885
US-11839140-B2 Metal complexes comprising diazabenzmidazolocarbene ligands and the use thereof in OLEDS OCIAD1, OCIAD2, DRD2 HPGDS 3245/4885LDLR 1757/4885PCSK9 4362/4885

“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.