SCHEMBL31489132

SCHEMBL31489132

CC(C)(NC(=O)C12CCC(O)(CC1)CC2)C(=O)N1CCC(c2ccc(NC(=O)N3Cc4cc(F)cnc4C3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 20/20 0.49
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL31488988 0.87 NAMPT (0.55) NAMPTCYP3A4CYP2C9
SCHEMBL31489115 0.85 NAMPT (0.51) NAMPT
SCHEMBL31488809 0.84 NAMPT (0.67) NAMPTCYP3A4CYP2C9
SCHEMBL31488937 0.83 NAMPT (0.54) NAMPT
SCHEMBL31489073 0.83 NAMPT (0.56) NAMPT
SCHEMBL31488943 0.83 NAMPT (0.54) NAMPTCYP3A4CYP2C9
SCHEMBL31489096 0.80 NAMPT (0.54) NAMPT
SCHEMBL31488870 0.79 NAMPT (0.68) NAMPTCYP3A4CYP2C9
SCHEMBL31488825 0.78 NAMPT (0.76) NAMPTCYP3A4CYP2C9
SCHEMBL31489123 0.77 NAMPT (0.55) 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-2025072437-A1 HETEROARYL COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS ALPHINA THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed