SCHEMBL470676

SCHEMBL470676

CCc1nc(N2CCC([C@H](C)Oc3cnc(N4C[C@H](NCl)[C@@H](c5cc(F)ccc5F)C4)nc3)CC2)no1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 16/20 0.39
ACACA Q13085 9/20 0.36
DPP4 P27487 2/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 2/20 0.33
DPP7 Q9UHL4 2/20 0.33
INPPL1 O15357 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
SCHEMBL470662 0.88 GPR119 (0.33) DPP4DPP8DPP9DPP7
SCHEMBL470699 0.84 DPP4 (0.35) DPP4DPP8DPP9DPP7INPPL1
SCHEMBL470672 0.84 ACACB (0.35) ACACBACACA
SCHEMBL470624 0.83 GPR119 (0.33) ACACBDPP4DPP8DPP9DPP7
SCHEMBL12064733 0.77 MCHR1 (0.44) ACACBACACADPP4DPP8DPP9
SCHEMBL12064798 0.77 GPR119 (0.40) DPP4
SCHEMBL12064977 0.77 GPR119 (0.38)
SCHEMBL462518 0.76 DPP4 (0.43) DPP4DPP8DPP9DPP7
SCHEMBL470695 0.76 DPP4 (0.39) DPP4DPP8DPP9DPP7
SCHEMBL12064555 0.76 GPR119 (0.35) DPP4DPP8DPP9DPP7

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