SCHEMBL6613507

SCHEMBL6613507

Cc1ccc(CNC(=O)n2nc(-c3ccc(NC(=O)c4ccc(C)cc4)cc3O)cc2C2CCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.42
▸ LMNA P02545 3/20 0.42
▸ NAMPT P43490 4/20 0.42
▸ POLB P06746 2/20 0.41
▸ MAPK14 Q16539 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CCR5 P51681 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ USP2 O75604 1/20 0.39

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
SCHEMBL6616947 0.96 SSTR3 (0.43) MAPTLMNANAMPTPOLBALDH1A1
SCHEMBL6620182 0.94 MAPT (0.47) MAPTLMNANAMPTPOLBMEN1
SCHEMBL6619787 0.93 MAPK14 (0.41) MAPTLMNANAMPTPOLBMAPK14
SCHEMBL6618105 0.93 CCR2 (0.40) MAPTLMNAPOLBMEN1KMT2A
SCHEMBL6673259 0.93 NAMPT (0.41) MAPTNAMPTPOLBMAPK14MEN1
SCHEMBL6616573 0.92 NR1H4 (0.41) MAPTLMNANAMPTMAPK14MEN1
SCHEMBL6615537 0.90 LMNA (0.45) MAPTLMNANAMPTPOLBKMT2A
SCHEMBL6618519 0.90 ALDH1A1 (0.42) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL6614784 0.89 POLB (0.41) MAPTPOLBMAPK14ALDH1A1CTNNB1
SCHEMBL6619665 0.89 P2RY14 (0.41) MAPTNAMPTPOLBMAPK14NPC1

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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