SCHEMBL3362196

SCHEMBL3362196

CCN(OC)C(=O)Cc1cnc(CNC(=O)OC(C)(C)C)c2cc(OC)c(OC)cc12

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 12/20 0.46
PDE10A Q9Y233 8/20 0.35

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
SCHEMBL3361880 0.85 DPP4 (0.47) DPP4PDE10A
SCHEMBL3361990 0.84 DPP4 (0.44) DPP4
SCHEMBL3360434 0.83 DPP4 (0.41) DPP4PDE10A
SCHEMBL3361800 0.81 CTSL (0.43) DPP4
SCHEMBL3362189 0.80 DPP4 (0.43) DPP4PDE10A
SCHEMBL3362959 0.80 DPP4 (0.40) DPP4PDE10A
SCHEMBL3363192 0.78 CYP3A4 (0.41) DPP4PDE10A
SCHEMBL3361314 0.78 NPC1 (0.44) DPP4
SCHEMBL3365064 0.78 KDM4E (0.43) DPP4PDE10A
SCHEMBL3363973 0.77 DPP4 (0.43) DPP4

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
US-7732446-B1 Dipeptidyl peptidase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-08 US disclosed