SCHEMBL7913397

SCHEMBL7913397

COC(=O)C(N)(Cc1ccc(OCC2CN(c3ccccc3C#N)C(=O)O2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 17/20 0.45
AR P10275 1/20 0.35

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
SCHEMBL7229499 0.89 GRM2 (0.45) GRM2
SCHEMBL7229268 0.86 GRM2 (0.49) GRM2
SCHEMBL7228415 0.85 GRM2 (0.63) GRM2
SCHEMBL7237371 0.85 GRM2 (0.49) GRM2
SCHEMBL7237956 0.84 GRM2 (0.41) GRM2
SCHEMBL7231999 0.83 GRM2 (0.49) GRM2
SCHEMBL7229075 0.80 GRM2 (0.47) GRM2
SCHEMBL7913396 0.80 PTPN1 (0.49) GRM2
SCHEMBL7238821 0.79 GRM2 (0.45) GRM2
SCHEMBL7235962 0.78 GRM2 (0.43) GRM2

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
US-6204280-B1 OXAZOLIDINONE DERIVATIVE, ANTICOAGULANT MERCK PATENT GESELLSCHAFT MIT BERSCHRANKTER HAFTUNG (DE) 2001-03-20 US disclosed