SCHEMBL24670539

SCHEMBL24670539

CC(C)(C)OC(=O)N=C(NCCSc1ccc(NC(=O)c2ccc(C3=CCN(C(=BOC#N)NC(=O)OC(C)(C)C)CC3)s2)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.32
ACKR3 P25106 1/20 0.30

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
SCHEMBL29803497 0.88 NAMPT (0.37) NAMPTACKR3
SCHEMBL24671055 0.80 NAMPT (0.45) NAMPTACKR3
SCHEMBL24669273 0.80 TRPV1 (0.31) NAMPT
SCHEMBL24670619 0.80 TRPV1 (0.34) NAMPT
SCHEMBL24670596 0.79 IMPDH2 (0.32) NAMPT
SCHEMBL29803846 0.79 MAPT (0.37) NAMPTACKR3
SCHEMBL24671335 0.79 MAPT (0.37) NAMPTACKR3
SCHEMBL24669299 0.77 NAMPT (0.32) NAMPT
SCHEMBL24671548 0.77 NAMPT (0.39) NAMPTACKR3
SCHEMBL29803457 0.76 NAMPT (0.47) 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-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed