SCHEMBL28111906

SCHEMBL28111906

NCc1ccccc1N1CCN(S(=O)(=O)c2ccc(NC(=O)NCc3cccnc3)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 20/20 0.78
CYP2C9 P11712 1/20 0.67

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
SCHEMBL161933 0.89 NAMPT (0.83) NAMPTCYP2C9
SCHEMBL29635738 0.89 NAMPT (0.83) NAMPTCYP2C9
SCHEMBL29635626 0.88 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL175663 0.88 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL28162252 0.86 NAMPT (0.83) NAMPTCYP2C9
SCHEMBL165510 0.86 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL163921 0.85 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL29635741 0.85 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL29635895 0.85 NAMPT (0.77) NAMPTCYP2C9
SCHEMBL164531 0.85 NAMPT (0.77) 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 2 patents. 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
CN-106986856-A It is used as 4 { [(ylmethyl of pyridine 3) amino carbonyl] amino } Benzosulfone derivatives of the NAMPT inhibitor for treating diseases such as cancer 福马TM有限责任公司 2017-07-28 CN disclosed