SCHEMBL7065803

SCHEMBL7065803

N=C(N)c1ccc(N2CC(COc3cccc4ncccc34)OC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 11/20 0.48
ITGB3 P05106 9/20 0.44
PRSS1 P07477 9/20 0.44
PRSS2 P07478 9/20 0.44
ITGA2B P08514 9/20 0.44
PRSS3 P35030 9/20 0.44
F10 P00742 6/20 0.43
F2 P00734 1/20 0.42

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
SCHEMBL7064670 0.88 GRM2 (0.54) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL2826791 0.87 GRM2 (0.64) GRM2
SCHEMBL7068849 0.87 GRM2 (0.48) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL7068163 0.84 GRM2 (0.46) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL7068856 0.81 GRM2 (0.48) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL7386950 0.79 GRM2 (0.63) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL7069185 0.79 GRM2 (0.53) GRM2
SCHEMBL7067396 0.79 GRM2 (0.53) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL7067982 0.79 GRM2 (0.53) GRM2ITGB3PRSS1PRSS2ITGA2B
SCHEMBL7387162 0.78 GRM2 (0.59) GRM2ITGB3PRSS1ITGA2BF10

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