SCHEMBL8275706

SCHEMBL8275706

CCOc1cc(C)ccc1-c1ccc(CNC(=O)[C@](C)(O)[C@@H](O)C(=O)N2Cc3cccnc3C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 14/20 0.42
▸ DPP8 Q6V1X1 1/20 0.39
▸ DPP9 Q86TI2 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL8223423 0.92 NAMPT (0.42) NAMPTDPP8DPP9
SCHEMBL12214264 0.81 NAMPT (0.43) NAMPTDPP8DPP9
SCHEMBL8221931 0.78 NAMPT (0.41) NAMPTDPP8DPP9
SCHEMBL8222522 0.76 NAMPT (0.40) NAMPTDPP8DPP9
SCHEMBL13542638 0.73 NAMPT (0.41) NAMPTDPP8DPP9
SCHEMBL8224584 0.71 NAMPT (0.39) NAMPTDPP8DPP9
SCHEMBL8418423 0.69 DPP8 (0.42) NAMPTDPP8DPP9
SCHEMBL8222517 0.68 NAMPT (0.37) NAMPTDPP8DPP9
SCHEMBL13542844 0.68 NAMPT (0.44) NAMPTDPP8DPP9
SCHEMBL8222058 0.67 DPP8 (0.42) NAMPTDPP8DPP9

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-2005121130-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2005-12-22 — — WO disclosed
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