SCHEMBL2907736

SCHEMBL2907736

COc1cc2c(O)cc(C(=O)O)nc2cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.52
ALOX15 P16050 1/20 0.52
IGFBP5 P24593 2/20 0.47
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
IGFBP3 P17936 4/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
ECE1 P42892 1/20 0.39
PTGS2 P35354 1/20 0.38
HTT P42858 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL2910842 0.89 ALOX15 (0.56) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL2910293 0.87 LCK (0.39) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL2907215 0.84 IGFBP5 (0.42) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL2907946 0.84 ALOX15 (0.51) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL561674 0.81 LCK (0.39) GPR35ALOX15ALDH1A1KDM4ELMNA
SCHEMBL2909742 0.79 IGFBP5 (0.43) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL2904639 0.79 GPR35 (0.46) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL11827386 0.79 IGFBP5 (0.47) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL11823904 0.77 IGFBP5 (0.46) GPR35ALOX15IGFBP5ALDH1A1KDM4E
SCHEMBL6593859 0.77 GPR35 (0.56) GPR35ALOX15IGFBP5ALDH1A1KDM4E

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578423-B1 2-AMINOCARBONYL-QUINOLINE COMPOUNDS AS PLATELET ADENOSINE DIPHOSPHATE RECEPTOR ANTAGONISTS BAYER SCHERING PHARMA AG (DE) 2010-08-18 EP disclosed
US-7176207-B2 Anticoagulants; antithrombotic agents in the treatment and prevention of thrombosis SCHERING AKTIENGESELLSCHAFT (DE) 2007-02-13 US disclosed
US-7084142-B2 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2006-08-01 US disclosed
US-20060135532-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-22 US disclosed
US-20060122188-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-08 US disclosed
US-7056923-B2 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-06 US disclosed
US-7026323-B2 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2006-04-11 US disclosed
US-6995156-B2 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2006-02-07 US disclosed
EP-1578423-A1 2-AMINOCARBONYL-QUINOLINE COMPOUNDS AS PLATELET ADENOSINE DIPHOSPHATE RECEPTOR ANTAGONISTS SCHERING AKTIENGESELLSCHAFT (DE) 2005-09-28 EP disclosed
US-20050065163-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-24 US disclosed
US-6861424-B2 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-01 US disclosed
US-20050038037-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2005-02-17 US disclosed
US-20040138229-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2004-07-15 US disclosed
WO-2004052366-A1 2-AMINOCARBONYL-QUINOLINE COMPOUNDS AS PLATELET ADENOSINE DIPHOSPHATE RECEPTOR ANTAGONISTS SCHERING AKTIENGESELLSCHAFT (DE) 2004-06-24 WO disclosed
US-20030060474-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2003-03-27 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-20060122188-A1 Platelet adenosine diphosphate receptor antagonists TBXA2R, P2RY1, ADORA1 GPR35 1319/4885ALOX15 1093/4885IGFBP5 4143/4885
US-20050065163-A1 Platelet adenosine diphosphate receptor antagonists ADORA2B, ADORA1, TBXA2R GPR35 1218/4885ALOX15 789/4885IGFBP5 3445/4885
US-20050038037-A1 Platelet adenosine diphosphate receptor antagonists ADORA2B, ADORA1, TBXA2R GPR35 1218/4885ALOX15 789/4885IGFBP5 3445/4885
US-20040138229-A1 Platelet adenosine diphosphate receptor antagonists TBXA2R, ADORA1, P2RY1 GPR35 1428/4885ALOX15 1084/4885IGFBP5 4245/4885
US-20030060474-A1 Platelet adenosine diphosphate receptor antagonists ADORA1, TBXA2R, ADORA2B GPR35 1412/4885ALOX15 763/4885IGFBP5 3553/4885
US-20060135532-A1 Platelet adenosine diphosphate receptor antagonists ADORA1, ADORA2B, TBXA2R GPR35 1190/4885ALOX15 861/4885IGFBP5 3455/4885

“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.