SCHEMBL462444

SCHEMBL462444

CC(C)c1nc(N2CCC(COS(C)(=O)=O)CC2)no1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.39
GPR183 P32249 1/20 0.38
CNR2 P34972 1/20 0.36
KCNH2 Q12809 1/20 0.35
SMO Q99835 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
SCHEMBL388551 0.78 GPR119 (0.59) GPR119GPR183KCNH2
SCHEMBL460939 0.78 MAPK8 (0.42) GPR119CNR2KCNH2
SCHEMBL1091984 0.77 GPR119 (0.47) GPR119GPR183CNR2
SCHEMBL1093027 0.76 GPR119 (0.39) GPR119GPR183CNR2
SCHEMBL1092389 0.75 GPR119 (0.54) GPR119GPR183
SCHEMBL21770159 0.75 LMNA (0.50) GPR119SMO
SCHEMBL462581 0.74 GPR119 (0.49) GPR119GPR183CNR2KCNH2
SCHEMBL1092705 0.74 GPR119 (0.48) GPR119GPR183
SCHEMBL870757 0.74 GPR119 (0.73) GPR119GPR183CNR2
SCHEMBL2371485 0.74 GPR119 (0.56) 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