SCHEMBL15530985

SCHEMBL15530985

O=C(NCc1ccc(S(=O)(=O)c2ccccc2)cn1)c1cc2ccncc2o1.O=C(NCc1ncc(S(=O)(=O)c2cc(F)cc(F)c2)cn1)c1cc2ccncc2o1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 20/20 0.84
▸ CYP2C9 P11712 2/20 0.84

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
SCHEMBL16858017 0.92 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL16820363 0.90 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL16820508 0.90 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL16858024 0.88 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL16858060 0.86 NAMPT (0.88) NAMPTCYP2C9
SCHEMBL16858127 0.84 NAMPT (0.88) NAMPTCYP2C9
SCHEMBL16858090 0.83 NAMPT (0.87) NAMPTCYP2C9
SCHEMBL15246420 0.83 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL15529988 0.82 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL15243625 0.81 NAMPT (1.00) NAMPTCYP2C9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013170191-A1 METHODS OF USING ANTAGONISTS OF NAD BIOSYNTHESIS FROM NICOTINAMIDE GENENTECH, INC. (US) 2013-11-14 — — WO disclosed
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