SCHEMBL1666808

SCHEMBL1666808

CCC[C@H](C)CN(C(=O)[C@@H]1C[C@H]1c1cccc(F)n1)c1ccc(-c2ccc(OC(C)C)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 20/20 0.73

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
SCHEMBL6889750 0.92 GPR88 (0.76) GPR88
SCHEMBL1666803 0.87 GPR88 (0.74) GPR88
SCHEMBL1667199 0.87 GPR88 (0.91) GPR88
SCHEMBL14877708 0.87 GPR88 (0.91) GPR88
SCHEMBL1668533 0.84 GPR88 (0.69) GPR88
SCHEMBL1668531 0.84 GPR88 (0.69) GPR88
SCHEMBL1667090 0.82 GPR88 (0.91) GPR88
SCHEMBL6888518 0.82 GPR88 (0.91) GPR88
SCHEMBL2519953 0.81 GPR88 (0.69) GPR88
SCHEMBL15145945 0.79 GPR88 (0.72) GPR88

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-2011044212-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 BRISTOL-MYERS SQUIBB COMPANY (US) 2011-04-14 WO disclosed