SCHEMBL28111905

SCHEMBL28111905

C=C(C(=O)O)c1cccc(S(=O)(=O)c2ccc(NC(=O)NCc3cccnc3)cc2)c1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 20/20 0.78
CYP2C9 P11712 1/20 0.74

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
SCHEMBL28111903 0.91 NAMPT (0.78) NAMPTCYP2C9
SCHEMBL163936 0.87 NAMPT (0.82) NAMPTCYP2C9
SCHEMBL163061 0.87 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL28112449 0.87 NAMPT (0.80) NAMPT
SCHEMBL161971 0.86 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL164452 0.85 NAMPT (0.84) NAMPTCYP2C9
SCHEMBL162810 0.85 NAMPT (0.81) NAMPTCYP2C9
SCHEMBL164285 0.84 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL22402237 0.84 NAMPT (0.80) NAMPTCYP2C9
SCHEMBL162250 0.84 NAMPT (0.81) 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
CN-103270023-B 4- { [ (pyridin-3-yl-methyl) aminocarbonyl ] amino } benzene-sulfone derivatives as NAMPT inhibitors for the treatment of diseases such as cancer 福马TM有限责任公司 2016-11-02 CN claimed