SCHEMBL6615259

SCHEMBL6615259

CCC(C)NC(=O)n1nc(-c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2O)cc1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ALPL P05186 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TRPV1 Q8NER1 4/20 0.39
▸ NAMPT P43490 5/20 0.39
▸ MAPK14 Q16539 1/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NR1H4 Q96RI1 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ KCNK9 Q9NPC2 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
SCHEMBL6621127 0.89 MEN1 (0.41) MEN1KMT2ATRPV1MAPK14NPC1
SCHEMBL6615959 0.88 P2RY14 (0.41) MEN1KMT2AGAAHTTL3MBTL1
SCHEMBL6617186 0.88 GCGR (0.44) TRPV1NAMPTNPC1RAB9A
SCHEMBL6621456 0.88 MEN1 (0.44) MEN1KMT2ATRPV1MAPK14NPC1
SCHEMBL6615338 0.86 RAF1 (0.44) MEN1KMT2AHTTMAPK14RAB9A
SCHEMBL6610153 0.86 MEN1 (0.41) MEN1KMT2ATRPV1NAMPTMAPK14
SCHEMBL6618182 0.85 MEN1 (0.43) MEN1KMT2ATRPV1MAPK14NPC1
SCHEMBL6615707 0.85 KMT2A (0.42) MEN1KMT2AGAANAMPTNPC1
SCHEMBL6616880 0.84 MEN1 (0.43) MEN1KMT2ATRPV1MAPK14NPC1
SCHEMBL6616697 0.84 KMT2A (0.44) MEN1KMT2AGAAL3MBTL1NPC1

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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