SCHEMBL6618475

SCHEMBL6618475

Cc1ccc(C(=O)Nc2ccc(O)c(-c3cc(C4CCC4)n(C(=O)NCCc4ccccc4)n3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ NAMPT P43490 2/20 0.40
▸ BACE1 P56817 2/20 0.40
▸ MAPT P10636 3/20 0.39
▸ CCR5 P51681 1/20 0.39
▸ MAPK14 Q16539 2/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ OPRK1 P41145 1/20 0.37
▸ SYK P43405 1/20 0.37
▸ KCNJ6 P48051 1/20 0.37
▸ KCNJ5 P48544 1/20 0.37
▸ KCNJ3 P48549 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ KDM6B O15054 1/20 0.36
▸ KDM5A P29375 1/20 0.36
▸ KDM4D Q6B0I6 1/20 0.36

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
SCHEMBL6621561 0.93 SMN1; SMN2 (0.40) RAB9ANPC1NAMPTMAPTMAPK14
SCHEMBL6608341 0.92 POLB (0.44) RAB9ANPC1NAMPTMAPTMAPK14
SCHEMBL6617649 0.90 RAB9A (0.43) RAB9ANAMPTKDM6BKDM5AKDM4D
SCHEMBL6615243 0.90 MAPK14 (0.41) RAB9ANPC1NAMPTMAPTCCR5
SCHEMBL6661397 0.89 CRACR2A (0.45) MAPTMEN1KMT2APOLBSMN1; SMN2
SCHEMBL6619787 0.88 MAPK14 (0.41) RAB9ANPC1NAMPTMAPTCCR5
SCHEMBL6616425 0.88 NAMPT (0.40) RAB9ANPC1NAMPTMAPTMAPK14
SCHEMBL6618994 0.87 NPC1 (0.49) RAB9ANPC1NAMPTMAPTKMT2A
SCHEMBL6620003 0.87 RAB9A (0.39) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL6623103 0.86 MAPK14 (0.40) RAB9ANPC1NAMPTMAPTMAPK14

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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