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SCHEMBL463105

SCHEMBL463105

CC(C)(C)OC(=O)N[C@H]1CN(c2ncc(OC[C@H]3CCN(c4ncc(Cl)cn4)C[C@@H]3O)cn2)C[C@@H]1c1cc(F)ccc1F

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 4/20 0.42
▸ KCNH2 Q12809 3/20 0.42
▸ RET P07949 7/20 0.40
▸ NTRK1 P04629 4/20 0.40
▸ EIF2AK4 Q9P2K8 1/20 0.40
▸ NPY5R Q15761 4/20 0.37

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
SCHEMBL462063 1.00 GPR119 (0.42) GPR119KCNH2RETNTRK1EIF2AK4
SCHEMBL462062 1.00 GPR119 (0.42) GPR119KCNH2RETNTRK1EIF2AK4
SCHEMBL470485 0.91 GPR119 (0.43) GPR119KCNH2RETNTRK1EIF2AK4
SCHEMBL148182 0.84 NTRK1 (0.38) GPR119KCNH2RETNTRK1EIF2AK4
SCHEMBL148181 0.84 NTRK1 (0.38) GPR119KCNH2RETNTRK1EIF2AK4
SCHEMBL12064746 0.82 MCHR1 (0.44) GPR119KCNH2
SCHEMBL12064703 0.81 MCHR1 (0.37) GPR119KCNH2RETNTRK1
SCHEMBL459423 0.81 GPR119 (0.41) GPR119RETNTRK1
SCHEMBL470590 0.81 NTRK1 (0.38) GPR119KCNH2RETNTRK1
SCHEMBL470735 0.80 NTRK1 (0.42) RETNTRK1NPY5R

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