SCHEMBL457393

SCHEMBL457393

CCc1cnc(N2CCC(CCOS(C)(=O)=O)CC2)nc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.48
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL1924194 0.93 GPR119 (0.54) GPR119KDM4ENPC1RAB9A
SCHEMBL1103984 0.87 GPR119 (0.48) GPR119KDM4ENPC1RAB9A
SCHEMBL2247872 0.84 GPR119 (0.48) GPR119KDM4ENPC1RAB9A
SCHEMBL15109948 0.81 GPR119 (0.44) GPR119KDM4ENPC1RAB9A
SCHEMBL17712603 0.80 GPR119 (0.49) GPR119KDM4ENPC1RAB9A
SCHEMBL1004837 0.79 GPR119 (0.53) GPR119KDM4ENPC1RAB9A
SCHEMBL2250812 0.79 GPR119 (0.45) GPR119
SCHEMBL23226149 0.79 GPR119 (0.43) GPR119
SCHEMBL12356451 0.77 GPR119 (0.53) GPR119KDM4ENPC1RAB9A
SCHEMBL19438238 0.77 GPR119 (0.47) GPR119

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