SCHEMBL3869852

SCHEMBL3869852

Cc1ccc(OCc2ccccc2)c(CO)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
MAPT P10636 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MAPK1 P28482 1/20 0.49
GRM5 P41594 1/20 0.48
ATP4A P20648 1/20 0.48
ATP4B P51164 1/20 0.48
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
STAT3 P40763 1/20 0.47
HTT P42858 1/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.45
LIPE Q05469 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
BRD4 O60885 2/20 0.43

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
SCHEMBL2892621 0.85 NPC1 (0.58) MAPTSMN1; SMN2HTTKDM4EALDH1A1
SCHEMBL2905332 0.85 RAB9A (0.52) SMN1; SMN2KDM4EALDH1A1HPGDNPC1
SCHEMBL15058530 0.85 MEN1 (0.58) L3MBTL1MAPTTDP1MAPK1TSHR
SCHEMBL8283853 0.84 TSHR (0.50) L3MBTL1MAPTTDP1MAPK1GRM5
SCHEMBL12226851 0.84 L3MBTL1 (0.49) L3MBTL1MAPTTDP1MAPK1GRM5
SCHEMBL4502335 0.84 MAPT (0.49) L3MBTL1MAPTTDP1MAPK1GRM5
SCHEMBL4120541 0.83 TSHR (0.49) L3MBTL1MAPTTDP1MAPK1GRM5
SCHEMBL17544850 0.83 ATP4A (0.47) L3MBTL1MAPTTDP1MAPK1ATP4A
SCHEMBL2904391 0.83 ATP4A (0.43) L3MBTL1MAPTTDP1MAPK1ATP4A
SCHEMBL24992521 0.81 USP28 (0.43) L3MBTL1MAPTTDP1MAPK1ATP4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794593-B1 SPIRO AMINIC COMPOUNDS AS OREXIN ANTAGONISTS Rottapharm Biotech Srl (IT) 2017-02-01 EP disclosed
EP-2794593-B1 SPIRO AMINIC COMPOUNDS AS OREXIN ANTAGONISTS Rottapharm Biotech Srl (IT) 2017-02-01 EP disclosed
US-9493438-B2 4,4-difluoro-piperidine-compounds ROTTAPHARM S.R.L. (IT) 2016-11-15 US disclosed
US-9493438-B2 4,4-difluoro-piperidine-compounds ROTTAPHARM S.R.L. (IT) 2016-11-15 US disclosed
US-9493438-B2 4,4-difluoro-piperidine-compounds ROTTAPHARM S.R.L. (IT) 2016-11-15 US disclosed
EP-2820007-B1 4,4-DIFLUORO-PIPERIDINE-COMPOUNDS Rottapharm Biotech Srl (IT) 2016-04-20 EP disclosed
EP-2820007-B1 4,4-DIFLUORO-PIPERIDINE-COMPOUNDS Rottapharm Biotech Srl (IT) 2016-04-20 EP disclosed
US-9062033-B2 Chemical compounds ROTTAPHARM BIOTECH S.R.L. (IT) 2015-06-23 US disclosed
US-9062033-B2 Chemical compounds ROTTAPHARM BIOTECH S.R.L. (IT) 2015-06-23 US disclosed
US-9062033-B2 Chemical compounds ROTTAPHARM BIOTECH S.R.L. (IT) 2015-06-23 US disclosed
US-20070015747-A1 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA, N.V. 2007-01-18 US disclosed
CN-1894236-A Amino-benzimidazole derivatives as inhibitors of respiratory syncytial virus replication TIBOTEC PHARM LTD (IE) 2007-01-10 CN disclosed
EP-1217001-B1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT EISAI CO LTD (JP) 2005-12-07 EP disclosed
US-6747028-B1 1,2-SUBSTITUTED BENZIMIDAZOLES HAVING ANTIVIRAL ACTIVITY HANSSEN PHARMACEUTICA, N.V. (BE) 2004-06-08 US disclosed
EP-1196409-B1 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2004-02-04 EP disclosed
US-6599917-B1 A squalene-synthesizing enzyme inhibitor, a cholesterol biosynthesis inhibitor and a triglyceride biosynthesis inhibitor EISAI CO., LTD. (JP) 2003-07-29 US disclosed
CN-1377349-A Quinuclidine compound and medicine containing the same as active ingredient EISAI CO LTD (JP) 2002-10-30 CN disclosed
EP-1217001-A1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed
EP-1196409-A2 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2002-04-17 EP disclosed
WO-2001000612-A2 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2001-01-04 WO 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 (1 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-20070015747-A1 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS SARS1, ACE, MAVS L3MBTL1 3155/4885MAPT 4749/4885TDP1 3502/4885

“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.