SCHEMBL8315766

SCHEMBL8315766

N#Cc1ccc(N2CC(CN3CCCCC3C(=O)O)OC2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 7/20 0.50
F10 P00742 6/20 0.39
F2 P00734 3/20 0.38
SIGMAR1 Q99720 4/20 0.38
HSD11B1 P28845 1/20 0.37

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
SCHEMBL8316229 0.97 GRM2 (0.51) GRM2F10F2SIGMAR1HSD11B1
SCHEMBL8948802 0.87 F10 (0.51) GRM2F10F2
SCHEMBL8948606 0.86 GRM2 (0.47) GRM2F10F2SIGMAR1
SCHEMBL8948645 0.86 FKBP1A (0.44) GRM2F10F2
SCHEMBL8315140 0.84 F10 (0.41) GRM2F10F2SIGMAR1
SCHEMBL8948753 0.84 GRM2 (0.51) GRM2F10F2
SCHEMBL8315109 0.83 F10 (0.54) GRM2F10F2
SCHEMBL8948811 0.83 GRM2 (0.48) GRM2F10F2SIGMAR1
SCHEMBL8948620 0.82 L3MBTL1 (0.44) GRM2SIGMAR1
SCHEMBL8312680 0.81 F10 (0.42) GRM2F10F2SIGMAR1

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-0623615-B1 Substituted 1-phenyl-oxazolidin-2-one derivatives, their preparation and their use as adhesion-receptor antagonists MERCK PATENT GMBH (DE) 1999-06-30 EP disclosed
US-5532255-A Adhesion receptor antagonists MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-07-02 US disclosed
EP-0623615-A1 Adhesion-receptor antagonists MERCK PATENT GmbH (DE) 1994-11-09 EP disclosed