SCHEMBL470695

SCHEMBL470695

CCc1noc(N2CCC([C@H](C)Oc3cnc(N4C[C@H](c5cc(F)ccc5F)[C@@H](N)C4)nc3)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 14/20 0.39
DPP8 Q6V1X1 10/20 0.39
DPP9 Q86TI2 8/20 0.39
MCHR1 Q99705 5/20 0.39
KCNH2 Q12809 3/20 0.39
DPP7 Q9UHL4 7/20 0.33
GPR119 Q8TDV5 2/20 0.33
FFAR1 O14842 1/20 0.32
FAP Q12884 2/20 0.31

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
SCHEMBL470902 0.93 DPP4 (0.34) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL470671 0.93 MCHR1 (0.37) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL462540 0.92 DPP4 (0.34) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL12064853 0.91 ALDH1A1 (0.34) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL470636 0.90 MCHR1 (0.37) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL470662 0.89 GPR119 (0.33) DPP4DPP8DPP9KCNH2DPP7
SCHEMBL461833 0.89 MCHR1 (0.36) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL12064750 0.87 MCHR1 (0.36) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL470692 0.87 MCHR1 (0.36) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL470624 0.86 GPR119 (0.33) DPP4DPP8DPP9KCNH2DPP7

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