SCHEMBL28111902

SCHEMBL28111902

C=C(C(=O)O)N(CCO)S(=O)(=O)c1ccc(NC(=O)NCc2cccnc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 20/20 0.68
CYP2C9 P11712 1/20 0.62

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
SCHEMBL164153 0.83 NAMPT (0.78) NAMPTCYP2C9
SCHEMBL167184 0.82 NAMPT (0.80) NAMPTCYP2C9
SCHEMBL165654 0.81 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL167702 0.80 NAMPT (0.81) NAMPTCYP2C9
SCHEMBL29635657 0.80 NAMPT (0.81) NAMPTCYP2C9
SCHEMBL165341 0.78 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL166366 0.78 NAMPT (0.81) NAMPTCYP2C9
SCHEMBL164990 0.77 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL29635675 0.77 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL15317991 0.77 NAMPT (0.78) 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