SCHEMBL7065739

SCHEMBL7065739

N=C(N)c1ccc(N2CC(COc3cccc(Oc4ccccc4)c3)OC2=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 16/20 0.63
F10 P00742 3/20 0.46
F2 P00734 1/20 0.46
FURIN P09958 1/20 0.46
ITGB3 P05106 3/20 0.46
ITGA2B P08514 3/20 0.46
PRSS1 P07477 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 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
SCHEMBL7069153 0.93 GRM2 (0.67) GRM2F10ITGB3ITGA2BPRSS1
SCHEMBL7068141 0.91 GRM2 (0.62) GRM2
SCHEMBL7065870 0.90 GRM2 (0.60) GRM2F10F2ITGB3ITGA2B
SCHEMBL7387162 0.90 GRM2 (0.59) GRM2F10F2ITGB3ITGA2B
SCHEMBL2826578 0.88 GRM2 (0.80) GRM2
SCHEMBL8361132 0.87 GRM2 (0.58) GRM2F10F2ITGB3ITGA2B
SCHEMBL7067364 0.86 GRM2 (0.64) GRM2
SCHEMBL7067302 0.86 GRM2 (0.57) GRM2F10ITGB3ITGA2BPRSS1
SCHEMBL8146333 0.86 GRM2 (0.61) GRM2F10F2ITGB3ITGA2B
SCHEMBL7068549 0.85 GRM2 (0.57) GRM2F10F2ITGB3ITGA2B

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