SCHEMBL462956

SCHEMBL462956

CC(C)c1noc(C(=O)N2CCC(COc3cnc(N4C[C@H](c5cc(F)c(F)cc5F)[C@@H](N)C4)nc3)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.39
DPP8 Q6V1X1 9/20 0.39
DPP7 Q9UHL4 8/20 0.39
DPP9 Q86TI2 7/20 0.39
GPR119 Q8TDV5 6/20 0.38
GPR183 P32249 1/20 0.38
KCNH2 Q12809 3/20 0.37
CYP2D6 P10635 1/20 0.37
MCHR1 Q99705 2/20 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
SCHEMBL470613 0.86 GPR119 (0.49) DPP4DPP8DPP7DPP9GPR119
SCHEMBL470574 0.82 GPR119 (0.45) GPR119GPR183KCNH2
SCHEMBL12064990 0.80 DPP4 (0.42) DPP4DPP8DPP7DPP9GPR119
SCHEMBL470604 0.79 GPR119 (0.49) DPP4DPP8DPP9GPR119GPR183
SCHEMBL121162 0.79 GPR119 (0.42) DPP4DPP8DPP7DPP9GPR119
SCHEMBL12064609 0.79 GPR119 (0.43) DPP4DPP8DPP7DPP9GPR119
SCHEMBL12064995 0.79 GPR119 (0.43) DPP4DPP8DPP7DPP9GPR119
SCHEMBL470648 0.78 GPR119 (0.49) DPP4GPR119GPR183KCNH2MCHR1
SCHEMBL12064799 0.78 GPR119 (0.42) DPP4DPP8DPP7DPP9GPR119
SCHEMBL470621 0.77 GPR119 (0.50) DPP4GPR119GPR183KCNH2MCHR1

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed