SCHEMBL470560

SCHEMBL470560

Bc1ccc(OCC2CCN(c3nc(C(C)C)no3)CC2)nc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 17/20 0.55
GPR183 P32249 1/20 0.54
CNR2 P34972 1/20 0.40
ACACB O00763 1/20 0.39
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL461992 0.88 GPR119 (0.55) GPR119GPR183CNR2ACACBABCB1
SCHEMBL470450 0.86 GPR119 (0.54) GPR119GPR183CNR2ABCB1ABCC1
SCHEMBL11956900 0.86 GPR119 (0.54) GPR119GPR183CNR2ACACB
SCHEMBL470623 0.84 GPR119 (0.53) GPR119GPR183CNR2
SCHEMBL13186690 0.84 GPR119 (0.46) GPR119GPR183CNR2KCNH2
SCHEMBL11978475 0.84 GPR119 (0.52) GPR119GPR183CNR2ACACB
SCHEMBL461663 0.82 GPR119 (0.54) GPR119GPR183CNR2ABCB1ABCC1
SCHEMBL12064532 0.81 GPR119 (0.66) GPR119GPR183CNR2ABCB1ABCC1
SCHEMBL1092906 0.81 GPR119 (0.58) GPR119GPR183ACACBKCNH2
SCHEMBL470642 0.80 GPR119 (0.50) GPR119GPR183CNR2ABCB1ABCC1

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