SCHEMBL28086955

SCHEMBL28086955

O=C(NCCCCC1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1)c1cc2cnccc2[nH]1.O=C(NCCCCC1CCN(S(=O)(=O)c2cccnc2)CC1)c1cc2cnccc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 20/20 0.58

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
SCHEMBL13738474 0.95 NAMPT (0.62) NAMPT
SCHEMBL13741063 0.93 NAMPT (0.63) NAMPT
SCHEMBL29944175 0.93 NAMPT (0.63) NAMPT
SCHEMBL13739647 0.90 NAMPT (0.59) NAMPT
SCHEMBL13740492 0.89 NAMPT (0.65) NAMPT
SCHEMBL29944342 0.89 NAMPT (0.59) NAMPT
SCHEMBL13739241 0.89 NAMPT (0.59) NAMPT
SCHEMBL13739328 0.88 NAMPT (0.64) NAMPT
SCHEMBL13739269 0.86 NAMPT (0.64) NAMPT
SCHEMBL13740149 0.86 NAMPT (0.64) 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
CN-103874686-B Piperidine derivatives and compositions for inhibition of nicotinamide phosphoribosyltransferase (NAMPT) 福马TM有限责任公司 2016-08-17 — — CN claimed
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