SCHEMBL8153467

SCHEMBL8153467

COC(=O)Cc1[nH]cc(OCC2CN(c3ccc(C#N)cc3)C(=O)O2)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 17/20 0.45

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
SCHEMBL8138419 0.91 GRM2 (0.46) GRM2
SCHEMBL8138901 0.88 GRM2 (0.43) GRM2
SCHEMBL8145603 0.87 ITGB3 (0.46) GRM2
SCHEMBL8150885 0.84 F10 (0.41) GRM2
SCHEMBL8147829 0.83 GRM2 (0.48) GRM2
SCHEMBL8137990 0.81 GRM2 (0.45) GRM2
SCHEMBL8152586 0.81 GRM2 (0.51) GRM2
SCHEMBL8151456 0.80 GRM2 (0.48) GRM2
SCHEMBL8139593 0.79 GRM2 (0.57) GRM2
SCHEMBL8152573 0.79 GRM2 (0.48) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6028090-A Adhesion receptor antagonists III MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-02-22 US disclosed
US-5723480-A Adhesion receptor antagonists III MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-03-03 US disclosed
US-5561148-A Adhesion receptor antagonists III MERCK PATENT GESELLSCHAFT MIT BESHRANKTER HAFTUNG (DE) 1996-10-01 US disclosed
EP-0645376-A1 Substituted 1-phenyl-oxazolidin-2-one derivatives, their preparation and their use as adhesion-receptor antagonists MERCK PATENT GmbH (DE) 1995-03-29 EP disclosed