SCHEMBL6119682

SCHEMBL6119682

O=C(NCCCCC1CCN(C(=O)c2ccccn2)CC1)N1Cc2ccccc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 20/20 1.00

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
SCHEMBL3704494 1.00 NAMPT (1.00) NAMPT
SCHEMBL24011427 0.85 NAMPT (0.74) NAMPT
SCHEMBL3701643 0.84 NAMPT (1.00) NAMPT
SCHEMBL3700127 0.82 NAMPT (1.00) NAMPT
SCHEMBL6122036 0.82 NAMPT (1.00) NAMPT
SCHEMBL3698860 0.79 NAMPT (1.00) NAMPT
SCHEMBL3698340 0.79 NAMPT (1.00) NAMPT
SCHEMBL24011380 0.78 NAMPT (0.64) NAMPT
SCHEMBL8151524 0.77 NAMPT (0.62) NAMPT
SCHEMBL3705040 0.77 NAMPT (0.69) 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 2 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 disclosed
WO-2012067965-A1 NAMPT AND ROCK INHIBITORS ABBOTT LABORATORIES (US) 2012-05-24 WO disclosed