SCHEMBL7068840

SCHEMBL7068840

N=C(N)c1ccc(N2CC(COc3cccc(C(=O)N4CCCCC4)c3)OC2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.51
GRM2 Q14416 11/20 0.50
PRSS1 P07477 2/20 0.50
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44

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
SCHEMBL7070016 0.99 GRM2 (0.51) F10GRM2PRSS1ITGB3ITGA2B
SCHEMBL7069724 0.93 F10 (0.51) F10GRM2PRSS1
SCHEMBL7064676 0.92 GRM2 (0.51) F10GRM2PRSS1
SCHEMBL7068866 0.89 GRM2 (0.52) F10GRM2PRSS1ITGB3ITGA2B
SCHEMBL7387162 0.89 GRM2 (0.59) F10GRM2PRSS1ITGB3ITGA2B
SCHEMBL7068549 0.88 GRM2 (0.57) F10GRM2PRSS1ITGB3ITGA2B
SCHEMBL7064507 0.88 F10 (0.49) F10GRM2PRSS1
SCHEMBL7064494 0.87 GRM2 (0.50) F10GRM2PRSS1
SCHEMBL7067394 0.86 GRM2 (0.57) F10GRM2PRSS1ITGB3ITGA2B
SCHEMBL7068138 0.85 F10 (0.54) F10GRM2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003047572-A1 USE OF 1-PHENYL-OXAZOLIDINE-2-ONE COMPOUNDS AS PROTEASE M INHIBITORS MERCK PATENT GMBH (DE) 2003-06-12 WO claimed
WO-2003047572-A1 USE OF 1-PHENYL-OXAZOLIDINE-2-ONE COMPOUNDS AS PROTEASE M INHIBITORS MERCK PATENT GMBH (DE) 2003-06-12 WO disclosed