SCHEMBL6615051

SCHEMBL6615051

Cc1ccccc1CNC(=O)n1nc(-c2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)cc2O)cc1C1CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SCN2A Q99250 1/20 0.42
▸ SCN10A Q9Y5Y9 1/20 0.42
▸ TRPV1 Q8NER1 2/20 0.41
▸ GCGR P47871 2/20 0.41
▸ NAMPT P43490 2/20 0.41
▸ CFD P00746 1/20 0.41
▸ GIPR P48546 1/20 0.41
▸ ABL1 P00519 5/20 0.41
▸ MCHR1 Q99705 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ HRH3 Q9Y5N1 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
SCHEMBL6613041 0.91 TRPV1 (0.44) TRPV1GCGRNAMPTGIPRABL1
SCHEMBL6619833 0.89 TRPV1 (0.43) TRPV1GCGRNAMPTGIPRABL1
SCHEMBL6618867 0.89 TP53 (0.41) TRPV1NAMPTMEN1KMT2ASMN1; SMN2
SCHEMBL6617061 0.89 TAOK1 (0.42) NAMPTABL1MCHR1LMNANPC1
SCHEMBL6615997 0.88 GCGR (0.45) TRPV1GCGRNAMPTGIPRABL1
SCHEMBL6615756 0.88 NAMPT (0.42) GCGRNAMPTGIPRABL1NPC1
SCHEMBL6619980 0.87 GCGR (0.45) GCGRNAMPTGIPRABL1NPC1
SCHEMBL6619665 0.86 P2RY14 (0.41) NAMPTNPC1RAB9AMAPT
SCHEMBL6616422 0.86 NAMPT (0.45) TRPV1GCGRNAMPTGIPRABL1
SCHEMBL6615889 0.84 TRPV1 (0.45) TRPV1GCGRNAMPTGIPRABL1

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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