SCHEMBL6614784

SCHEMBL6614784

Cc1ccc(C(=O)Nc2ccc(O)c(-c3cc(C4CCC4)n(C(=O)NCc4ccc(F)cc4)n3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CTNNB1 P35222 12/20 0.40
▸ TCF7L2 Q9NQB0 12/20 0.40
▸ SSTR3 P32745 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ MAPK14 Q16539 1/20 0.39
▸ OPRK1 P41145 1/20 0.38
▸ P2RY14 Q15391 1/20 0.38

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
SCHEMBL6619787 0.96 MAPK14 (0.41) POLBALDH1A1MAPTMAPK14P2RY14
SCHEMBL6616947 0.94 SSTR3 (0.43) POLBALDH1A1CTNNB1TCF7L2SSTR3
SCHEMBL6608341 0.92 POLB (0.44) POLBALDH1A1MAPTMAPK14P2RY14
SCHEMBL6615977 0.92 LMNA (0.42) POLBMAPTMAPK14P2RY14
SCHEMBL6618517 0.91 KDM4E (0.45) POLBALDH1A1MAPT
SCHEMBL6614050 0.90 GCGR (0.43) CTNNB1TCF7L2
SCHEMBL6613507 0.89 MAPT (0.42) POLBALDH1A1CTNNB1TCF7L2MAPT
SCHEMBL6616656 0.89 LMNA (0.39) POLBALDH1A1MAPTMAPK14
SCHEMBL6616425 0.89 NAMPT (0.40) POLBALDH1A1MAPTMAPK14
SCHEMBL6651951 0.88 P2RY14 (0.41) POLBMAPTMAPK14P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP claimed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO claimed
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