SCHEMBL6618495

SCHEMBL6618495

Cc1ccccc1CNC(=O)n1nc(-c2cc(NC(=O)C3CC3)ccc2O)cc1C1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNRHR P30968 1/20 0.40
▸ UBE2M P61081 1/20 0.39
▸ DCUN1D1 Q96GG9 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ EPHX2 P34913 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MAPK14 Q16539 3/20 0.37
▸ BCHE P06276 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 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
SCHEMBL6616981 0.95 GNRHR (0.41) GNRHRUBE2MDCUN1D1KMT2ANPC1
SCHEMBL6617727 0.91 GNRHR (0.39) GNRHRKMT2ANPC1RAB9AALDH1A1
SCHEMBL6619186 0.90 MEN1 (0.38) KMT2ANPC1RAB9AEPHX2ALDH1A1
SCHEMBL6617729 0.90 EPHX2 (0.37) GNRHRKMT2ANPC1RAB9AEPHX2
SCHEMBL6620229 0.88 PPARG (0.42) KMT2ANPC1RAB9AEPHX2MAPT
SCHEMBL6618491 0.88 MEN1 (0.45) KMT2ANPC1RAB9AALDH1A1MAPT
SCHEMBL6617721 0.88 EPHX2 (0.39) KMT2ANPC1RAB9AEPHX2MAPT
SCHEMBL6603910 0.87 NAMPT (0.42) EPHX2MAPK14KDM4E
SCHEMBL6614450 0.87 ALDH1A1 (0.41) KMT2ANPC1RAB9AALDH1A1MAPT
SCHEMBL6623103 0.86 MAPK14 (0.40) NPC1RAB9AEPHX2MAPTMAPK14

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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