SCHEMBL18949495

SCHEMBL18949495

C/N=C(\NCc1ccc(S(=O)(=O)c2cccc(C(=O)NC3CCCC3)c2)cc1)Nc1ccncc1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 19/20 0.74
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL157722 0.90 NAMPT (0.73) NAMPT
SCHEMBL160946 0.86 NAMPT (0.72) NAMPT
SCHEMBL18949505 0.84 NAMPT (0.77) NAMPT
SCHEMBL18949524 0.83 NAMPT (0.73) NAMPT
SCHEMBL18949613 0.80 NAMPT (0.69) NAMPT
SCHEMBL18949502 0.79 NAMPT (0.69) NAMPTALDH1A1
SCHEMBL18949579 0.79 NAMPT (0.63) NAMPT
SCHEMBL166135 0.78 NAMPT (0.82) NAMPT
SCHEMBL18949496 0.78 NAMPT (0.66) NAMPT
SCHEMBL18949573 0.78 NAMPT (0.66) NAMPT

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
US-9676721-B2 Compounds and compositions for the inhibition of NAMPT FORMA TM, LLC (US) 2017-06-13 US disclosed