SCHEMBL18949639

SCHEMBL18949639

CCNC(=O)c1ccc(S(=O)(=O)c2ccc(CN/C(=N\C)Nc3ccncc3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 15/20 0.70
▸ CA2 P00918 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.47
▸ HTT P42858 1/20 0.47

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
SCHEMBL160914 0.88 NAMPT (0.69) NAMPT
SCHEMBL15372317 0.85 NAMPT (0.73) NAMPTCA2TDP1HTT
SCHEMBL18949526 0.83 NAMPT (0.64) NAMPT
SCHEMBL18949594 0.82 NAMPT (0.62) NAMPT
SCHEMBL18949584 0.82 NAMPT (0.62) NAMPT
SCHEMBL18949571 0.81 NAMPT (0.61) NAMPT
SCHEMBL18949562 0.80 NAMPT (0.72) NAMPT
SCHEMBL162521 0.80 NAMPT (0.72) NAMPT
SCHEMBL18949613 0.79 NAMPT (0.69) NAMPT
SCHEMBL18949524 0.79 NAMPT (0.73) 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
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