SCHEMBL470534

SCHEMBL470534

COc1nc(N2C[C@H](NC(=O)OC(C)(C)C)[C@@H](c3cc(F)ccc3F)C2)ncc1OCC1CCN(c2nc(C(C)C)no2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.41
GPR183 P32249 1/20 0.37
RBP4 P02753 2/20 0.34
TTR P02766 2/20 0.34
KCNH2 Q12809 2/20 0.34
NTRK1 P04629 2/20 0.34
CHRM4 P08173 1/20 0.33
ACACB O00763 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL470516 0.87 GPR119 (0.41) GPR119GPR183KCNH2NTRK1ACACB
SCHEMBL470490 0.86 GPR119 (0.40) GPR119GPR183RBP4TTRKCNH2
SCHEMBL470479 0.85 GPR119 (0.36) GPR119KCNH2NTRK1
SCHEMBL12064975 0.84 GPR119 (0.39) GPR119GPR183KCNH2NTRK1
SCHEMBL12064792 0.84 GPR119 (0.45) GPR119GPR183KCNH2ACACB
SCHEMBL470743 0.84 GPR119 (0.36) GPR119GPR183KCNH2NTRK1
SCHEMBL149964 0.83 GPR119 (0.38) GPR119GPR183KCNH2NTRK1
SCHEMBL149962 0.83 GPR119 (0.38) GPR119GPR183KCNH2NTRK1
SCHEMBL470525 0.83 GPR119 (0.36) GPR119GPR183KCNH2NTRK1
SCHEMBL149963 0.83 GPR119 (0.38) GPR119GPR183KCNH2NTRK1

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