SCHEMBL29620714

SCHEMBL29620714

COc1cc(C(=O)NC[C@](O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@]3(C)Cc2ncc[nH]2)C(F)(F)F)cc2cccnc12

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 18/20 0.37
POLB P06746 1/20 0.34

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
SCHEMBL24345300 1.00 NAMPT (0.37) NAMPTPOLB
SCHEMBL24345472 0.90 POLB (0.35) NAMPTPOLB
SCHEMBL29620707 0.90 POLB (0.35) NAMPTPOLB
SCHEMBL24346314 0.90 POLB (0.35) NAMPTPOLB
SCHEMBL24345458 0.90 POLB (0.37) POLB
SCHEMBL24345299 0.89 POLB (0.36) POLB
SCHEMBL24345459 0.89 POLB (0.39) POLB
SCHEMBL24985386 0.88 POLB (0.36) POLB
SCHEMBL24985387 0.88 POLB (0.36) POLB
SCHEMBL24984633 0.88 POLB (0.35) POLB

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-2022086840-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2022-04-28 WO disclosed