SCHEMBL24670485

SCHEMBL24670485

Cc1c(C2=CCN(C(=BOC#N)NC(=O)OC(C)(C)C)CC2)csc1C(=O)Nc1ccc(C2=CCN(C(=NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 18/20 0.38
BTK Q06187 1/20 0.31
WNT3A P56704 1/20 0.31

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
SCHEMBL29803723 0.91 NAMPT (0.45) NAMPTBTKWNT3A
SCHEMBL24671285 0.84 NAMPT (0.40) NAMPT
SCHEMBL24669229 0.84 NAMPT (0.44) NAMPTBTK
SCHEMBL24671301 0.84 NAMPT (0.44) NAMPTBTK
SCHEMBL24669905 0.83 NAMPT (0.43) NAMPTBTK
SCHEMBL24670619 0.79 TRPV1 (0.34) NAMPT
SCHEMBL24669273 0.79 TRPV1 (0.31) NAMPT
SCHEMBL24670596 0.79 IMPDH2 (0.32) NAMPTWNT3A
SCHEMBL24670524 0.78 NAMPT (0.45) NAMPTWNT3A
SCHEMBL29803650 0.78 NAMPT (0.45) NAMPTWNT3A

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