SCHEMBL905117

SCHEMBL905117

C[S+]([O-])c1ccc2c(c1)CCN2c1ncnc2c(C3CCN(C(=O)OC(C)(C)C)CC3)noc12

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.60

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
SCHEMBL905138 0.88 GPR119 (0.77) GPR119
SCHEMBL905090 0.79 GPR119 (0.46) GPR119
SCHEMBL905089 0.78 GPR119 (0.62) GPR119
SCHEMBL3242125 0.78 GPR119 (0.55) GPR119
SCHEMBL905158 0.77 GPR119 (0.62) GPR119
SCHEMBL3238881 0.76 GPR119 (0.59) GPR119
SCHEMBL905105 0.76 GPR119 (0.59) GPR119
SCHEMBL905161 0.76 GPR119 (0.59) GPR119
SCHEMBL905155 0.76 GPR119 (0.59) GPR119
SCHEMBL14883508 0.75 GPR119 (0.81) 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-2012043505-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL CONTAINING SAME 興和株式会社 (JP) 2012-04-05 WO disclosed