SCHEMBL6617918

SCHEMBL6617918

NC(=O)n1cccn1.O=C(Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccc(F)cc3)n2)c1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 3/20 0.39
▸ GCGR P47871 4/20 0.37
▸ DDR1 Q08345 1/20 0.37
▸ DDR2 Q16832 1/20 0.37
▸ GIPR P48546 3/20 0.37
▸ ABL1 P00519 6/20 0.36
▸ EGLN1 Q9GZT9 1/20 0.36
▸ CXCR2 P25025 1/20 0.36
▸ SLC2A1 P11166 1/20 0.35
▸ CTNNB1 P35222 1/20 0.35
▸ TCF7L2 Q9NQB0 1/20 0.35
▸ FAAH O00519 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ AURKA O14965 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34

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
SCHEMBL6616422 0.87 NAMPT (0.45) NAMPTGCGRDDR1DDR2GIPR
SCHEMBL6615941 0.85 GCGR (0.37) GCGRDDR1DDR2GIPRABL1
SCHEMBL6614050 0.84 GCGR (0.43) NAMPTGCGRGIPRABL1CTNNB1
SCHEMBL6619674 0.82 NAMPT (0.43) NAMPTSLC2A1
SCHEMBL6619980 0.81 GCGR (0.45) NAMPTGCGRGIPRABL1SLC2A1
SCHEMBL6615997 0.81 GCGR (0.45) NAMPTGCGRGIPRABL1CTNNB1
SCHEMBL6651122 0.81 NAMPT (0.40) NAMPTGCGRDDR1DDR2GIPR
SCHEMBL6617661 0.81 GCGR (0.41) NAMPTGCGRGIPRABL1CTNNB1
SCHEMBL6619043 0.80 SLC2A1 (0.42) NAMPTGCGRGIPRABL1SLC2A1
SCHEMBL6616710 0.80 ABL1 (0.35) NAMPTGCGRDDR1DDR2GIPR

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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