SCHEMBL8799676

SCHEMBL8799676

CS(=O)(=O)OC[C@@H]1CN(c2ccccc2)C(=O)O1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 20/20 0.65

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
SCHEMBL6955426 1.00 GRM2 (0.65) GRM2
SCHEMBL3331808 1.00 GRM2 (0.65) GRM2
SCHEMBL12728925 0.88 GRM2 (0.60) GRM2
SCHEMBL8798953 0.87 GRM2 (0.57) GRM2
SCHEMBL13298874 0.87 GRM2 (0.49) GRM2
SCHEMBL6960959 0.87 GRM2 (0.57) GRM2
SCHEMBL6966303 0.87 GRM2 (0.59) GRM2
SCHEMBL7292670 0.87 GRM2 (0.59) GRM2
SCHEMBL6957780 0.87 GRM2 (0.57) GRM2
SCHEMBL8695799 0.87 GRM2 (0.59) 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 3 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-0635505-A1 4-Aryloxy- and 4-arylthiopiperidine derivatives MERCK PATENT GmbH (DE) 1995-01-25 EP disclosed