SCHEMBL470625

SCHEMBL470625

C=C1CN(c2ncc(O[C@@H](C)C3CCN(c4nc(CC)no4)CC3)cn2)C[C@@H]1N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.33
GPR183 P32249 1/20 0.33
ACACB O00763 1/20 0.30
ALOX5AP P20292 1/20 0.30

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
SCHEMBL470585 0.86 GPR119 (0.35) GPR119GPR183ACACBALOX5AP
SCHEMBL12064808 0.85 ALOX5AP (0.35) GPR119GPR183ALOX5AP
SCHEMBL12064853 0.77 ALDH1A1 (0.34) GPR119GPR183
SCHEMBL462547 0.76 GPR119 (0.32) GPR119GPR183ACACBALOX5AP
SCHEMBL462545 0.76 GPR119 (0.32) GPR119GPR183ACACBALOX5AP
SCHEMBL462546 0.76 GPR119 (0.32) GPR119GPR183ACACBALOX5AP
SCHEMBL470695 0.76 DPP4 (0.39) GPR119
SCHEMBL470902 0.75 DPP4 (0.34) GPR119GPR183ACACB
SCHEMBL463070 0.75 GPR119 (0.32) GPR119GPR183
SCHEMBL463068 0.75 GPR119 (0.32) GPR119GPR183

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