SCHEMBL470516

SCHEMBL470516

CC(C)c1noc(N2CCC(COc3ccc(N4C[C@H](NC(=O)OC(C)(C)C)[C@@H](c5cc(F)ccc5F)C4)cn3)CC2)n1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.41
GPR183 P32249 1/20 0.38
ACACB O00763 5/20 0.36
DPP4 P27487 1/20 0.36
NTRK1 P04629 3/20 0.34
KCNH2 Q12809 1/20 0.34
NR1H2 P55055 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
SCHEMBL470534 0.87 GPR119 (0.41) GPR119GPR183ACACBNTRK1KCNH2
SCHEMBL470490 0.87 GPR119 (0.40) GPR119GPR183ACACBNTRK1KCNH2
SCHEMBL470689 0.84 GPR119 (0.45) GPR119GPR183ACACBDPP4KCNH2
SCHEMBL470479 0.83 GPR119 (0.36) GPR119NTRK1KCNH2NR1H2
SCHEMBL12064975 0.82 GPR119 (0.39) GPR119GPR183NTRK1KCNH2NR1H2
SCHEMBL12064792 0.82 GPR119 (0.45) GPR119GPR183ACACBKCNH2
SCHEMBL147233 0.82 GPR119 (0.39) GPR119GPR183ACACBNTRK1KCNH2
SCHEMBL149962 0.81 GPR119 (0.38) GPR119GPR183NTRK1KCNH2NR1H2
SCHEMBL149964 0.81 GPR119 (0.38) GPR119GPR183NTRK1KCNH2NR1H2
SCHEMBL470525 0.81 GPR119 (0.36) GPR119GPR183NTRK1KCNH2NR1H2

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