SCHEMBL4554600

SCHEMBL4554600

CS(=O)(=O)c1ccc([C@H]2CC(C3CCNCC3)CCN2c2nc(Cl)ns2)cn1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 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
SCHEMBL4555404 0.88 GPR119 (0.30) GPR119
SCHEMBL4553713 0.75 GPR119 (0.32) GPR119
SCHEMBL3623876 0.73 GPR119 (0.47) GPR119
SCHEMBL4554110 0.71
SCHEMBL3625467 0.67 GPR119 (0.49) GPR119
SCHEMBL2781696 0.63 GPR119 (0.43) GPR119
SCHEMBL10276049 0.62 GPR119 (0.59) GPR119
SCHEMBL4434868 0.60 GPR119 (0.45) GPR119
SCHEMBL3624026 0.60 GPR119 (0.41) GPR119
SCHEMBL789442 0.60 FPR2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121661-A1 BIPIPERIDINYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT Merck & Co., Inc. (US) 2009-11-25 EP disclosed
WO-2008085316-A1 BIPIPERIDINYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 2008-07-17 WO disclosed