SCHEMBL6128294

SCHEMBL6128294

CCC(CNC(=O)c1ccc(NC(=O)N2Cc3ccccc3C2)cc1)(N1CCOCC1)S(C)(=O)=O

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 20/20 0.74

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
SCHEMBL3698404 0.85 NAMPT (1.00) NAMPT
SCHEMBL3706129 0.84 NAMPT (1.00) NAMPT
SCHEMBL3707922 0.76 NAMPT (1.00) NAMPT
SCHEMBL3703231 0.76 NAMPT (1.00) NAMPT
SCHEMBL3703004 0.76 NAMPT (1.00) NAMPT
SCHEMBL3701636 0.75 NAMPT (1.00) NAMPT
SCHEMBL3699509 0.74 NAMPT (1.00) NAMPT
SCHEMBL3699832 0.74 NAMPT (1.00) NAMPT
SCHEMBL3700223 0.73 NAMPT (1.00) NAMPT
SCHEMBL3705388 0.73 NAMPT (0.79) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2640698-A1 NAMPT AND ROCK INHIBITORS AbbVie Inc. (US) 2013-09-25 EP claimed
WO-2012067965-A1 NAMPT AND ROCK INHIBITORS ABBOTT LABORATORIES (US) 2012-05-24 WO claimed
EP-2640698-A1 NAMPT AND ROCK INHIBITORS AbbVie Inc. (US) 2013-09-25 EP disclosed
WO-2012067965-A1 NAMPT AND ROCK INHIBITORS ABBOTT LABORATORIES (US) 2012-05-24 WO disclosed