SCHEMBL7299686

SCHEMBL7299686

COc1ccc(N2CC(CCOS(C)(=O)=O)OC2=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.64
SIGMAR1 Q99720 11/20 0.51

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
SCHEMBL9844135 1.00 GRM2 (0.64) GRM2SIGMAR1
SCHEMBL8798938 0.93 GRM2 (0.68) GRM2SIGMAR1
SCHEMBL1712583 0.88 GRM2 (0.53) GRM2
SCHEMBL1712585 0.88 GRM2 (0.53) GRM2
SCHEMBL1223893 0.88 GRM2 (0.65) GRM2SIGMAR1
SCHEMBL7291016 0.88 GRM2 (0.65) GRM2SIGMAR1
SCHEMBL1223892 0.88 GRM2 (0.65) GRM2SIGMAR1
SCHEMBL7298934 0.87 GRM2 (0.61) GRM2SIGMAR1
SCHEMBL7300334 0.87 GRM2 (0.61) GRM2SIGMAR1
SCHEMBL7291394 0.85 GRM2 (0.47) GRM2SIGMAR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635505-B1 4-Aryloxy- and 4-arylthiopiperidine derivatives MERCK PATENT GMBH (DE) 1997-10-15 EP disclosed
US-5561145-A 4-aryloxy- and 4-arylthiopiperidine derivatives MERCK PATENT GESELLSCHAFT MIT BESHRANKTER HAFTUNG (DE) 1996-10-01 US disclosed
EP-0459256-B1 Oxazolidinones with CNS-depressant activity MERCK PATENT GMBH (DE) 1995-07-12 EP disclosed
EP-0635505-A1 4-Aryloxy- and 4-arylthiopiperidine derivatives MERCK PATENT GmbH (DE) 1995-01-25 EP disclosed
US-5232931-A OXAZOLIDINONES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-08-03 US disclosed
EP-0459256-A1 Oxazolidinones with CNS-depressant activity MERCK PATENT GmbH (DE) 1991-12-04 EP disclosed
EP-0443197-A2 Oxazolidinones MERCK PATENT GmbH (DE) 1991-08-28 EP disclosed