SCHEMBL24947713

SCHEMBL24947713

O=C(O)c1ccc(NC(=O)N2Cc3ccc(Br)cc3C2)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 19/20 0.67
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53

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
SCHEMBL30877515 1.00 NAMPT (0.67) NAMPTNPC1RAB9A
SCHEMBL3702359 0.84 NAMPT (0.68) NAMPT
SCHEMBL3703713 0.83 NAMPT (0.77) NAMPTNPC1RAB9A
SCHEMBL24947597 0.82 NAMPT (0.68) NAMPTNPC1RAB9A
SCHEMBL3697374 0.81 NAMPT (1.00) NAMPT
SCHEMBL3706031 0.78 RAB9A (0.81) NAMPTNPC1RAB9A
SCHEMBL3705220 0.78 NAMPT (1.00) NAMPT
SCHEMBL20611950 0.76 NAMPT (0.55) NAMPTNPC1RAB9A
SCHEMBL3705990 0.76 NAMPT (1.00) NAMPT
SCHEMBL3698598 0.76 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
WO-2023007147-A1 6-SUBSTITUTED NAPHTHALENE-1,3-DISULFONIC ACID DERIVATIVES AS MODULATORS OF THE EXTRACELLULAR NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE (ENAMPT) FOR THE TREATMENT OF E.G. DIABETES THE UNIVERSITY OF MANCHESTER (GB) 2023-02-02 WO disclosed