SCHEMBL22923682

SCHEMBL22923682

CC1CC(=O)N(Cc2ccc(NC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)c(F)c2)N=C1c1ccc(NC(=O)N2Cc3ccncc3C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 19/20 0.41
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38

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
SCHEMBL22923683 0.92 NAMPT (0.46) NAMPT
SCHEMBL22923672 0.89 NAMPT (0.38) NAMPT
SCHEMBL22923645 0.88 NAMPT (0.37) NAMPT
SCHEMBL22923525 0.86 NAMPT (0.44) NAMPTHDAC1HDAC2
SCHEMBL22923650 0.85 NAMPT (0.35) NAMPT
SCHEMBL22923694 0.84 HDAC2 (0.49) NAMPTHDAC1HDAC2
SCHEMBL22923734 0.83 NAMPT (0.41) NAMPTHDAC1HDAC2
SCHEMBL31420785 0.83 NAMPT (0.46) NAMPT
SCHEMBL22923640 0.80 NAMPT (0.42) NAMPT
SCHEMBL22923767 0.79 NAMPT (0.49) 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-2021013693-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-01-28 WO disclosed