SCHEMBL470450

SCHEMBL470450

Bc1cnc(OCC2CCN(c3nc(C(C)C)no3)CC2)cn1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.54
GPR183 P32249 1/20 0.52
ABCB1 P08183 1/20 0.37
ABCC1 P33527 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
CNR2 P34972 1/20 0.37
KCNH2 Q12809 1/20 0.36

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
SCHEMBL461663 0.87 GPR119 (0.54) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL470560 0.86 GPR119 (0.55) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL11956897 0.85 GPR119 (0.51) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL12064532 0.84 GPR119 (0.66) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL13186692 0.84 GPR119 (0.46) GPR119GPR183KCNH2
SCHEMBL461992 0.82 GPR119 (0.55) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL28718027 0.81 GPR119 (0.54) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL11956900 0.81 GPR119 (0.54) GPR119GPR183CNR2
SCHEMBL12064533 0.80 GPR119 (0.53) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL1093043 0.80 GPR119 (0.56) GPR119GPR183KCNH2

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