SCHEMBL470613

SCHEMBL470613

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.49
GPR183 P32249 1/20 0.49
KCNH2 Q12809 4/20 0.43
DPP4 P27487 6/20 0.42
DPP8 Q6V1X1 3/20 0.38
DPP7 Q9UHL4 2/20 0.38
DPP9 Q86TI2 2/20 0.38
CYP2D6 P10635 1/20 0.36
MCHR1 Q99705 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
SCHEMBL470604 0.92 GPR119 (0.49) GPR119GPR183KCNH2DPP4DPP8
SCHEMBL121162 0.92 GPR119 (0.42) GPR119GPR183KCNH2DPP4DPP8
SCHEMBL470648 0.91 GPR119 (0.49) GPR119GPR183KCNH2DPP4MCHR1
SCHEMBL470621 0.90 GPR119 (0.50) GPR119GPR183KCNH2DPP4MCHR1
SCHEMBL12064995 0.90 GPR119 (0.43) GPR119GPR183KCNH2DPP4DPP8
SCHEMBL12064609 0.90 GPR119 (0.43) GPR119GPR183KCNH2DPP4DPP8
SCHEMBL12064799 0.89 GPR119 (0.42) GPR119GPR183KCNH2DPP4DPP8
SCHEMBL470626 0.88 GPR119 (0.49) GPR119GPR183KCNH2DPP4
SCHEMBL122265 0.88 GPR119 (0.41) GPR119GPR183KCNH2DPP4DPP8
SCHEMBL12064993 0.88 GPR119 (0.41) GPR119GPR183KCNH2DPP4DPP8

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