SCHEMBL459455

SCHEMBL459455

CCc1cnc(N2CCC([C@H](C)Oc3cnc(Cl)nc3)CC2)cn1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.33
HRH3 Q9Y5N1 3/20 0.33
SMO Q99835 1/20 0.31
PANK3 Q9H999 1/20 0.31
ACACB O00763 3/20 0.31
HRH4 Q9H3N8 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
SCHEMBL459456 0.80 GPR119 (0.41) GPR119SMOACACB
SCHEMBL470645 0.79 GPR119 (0.40) GPR119ACACB
SCHEMBL12989025 0.79 ACHE (0.38) GPR119HRH3HRH4
SCHEMBL470849 0.77 GPR119 (0.41) GPR119ACACB
SCHEMBL470548 0.76 HRH3 (0.38) GPR119HRH3HRH4
SCHEMBL9925927 0.75 MAPT (0.47) GPR119HRH4
SCHEMBL470678 0.75 GPR119 (0.41) GPR119HRH3
SCHEMBL8513708 0.71 SMO (0.42) GPR119SMOHRH4
SCHEMBL11919298 0.71 CKS1B (0.49) GPR119HRH3HRH4
SCHEMBL470748 0.70 GPR119 (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
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed