SCHEMBL1553718

SCHEMBL1553718

CCC[C@@H](C)COc1ccc(C(CO)NC(=O)O)cc1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 20/20 0.75

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
SCHEMBL2520989 1.00 GPR88 (0.75) GPR88
SCHEMBL27887826 0.90 GPR88 (0.74) GPR88
SCHEMBL1554890 0.90 GPR88 (0.74) GPR88
SCHEMBL13560366 0.89 GPR88 (0.60) GPR88
SCHEMBL2521097 0.86 GPR88 (1.00) GPR88
SCHEMBL6881141 0.86 GPR88 (1.00) GPR88
SCHEMBL6880190 0.86 GPR88 (0.73) GPR88
SCHEMBL2523748 0.86 GPR88 (1.00) GPR88
SCHEMBL2522184 0.85 GPR88 (1.00) GPR88
SCHEMBL2507657 0.84 GPR88 (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486030-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 Bristol-Myers Squibb Company (US) 2012-08-15 EP disclosed
WO-2011044195-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 BRISTOL-MYERS SQUIBB COMPANY (US) 2011-04-14 WO disclosed