SCHEMBL7069153

SCHEMBL7069153

N=C(N)c1ccc(N2CC(COc3ccc(Oc4ccccc4)cc3)OC2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 16/20 0.67
F10 P00742 2/20 0.47
ITGB3 P05106 2/20 0.47
PRSS1 P07477 2/20 0.47
PRSS2 P07478 2/20 0.47
ITGA2B P08514 2/20 0.47
PRSS3 P35030 2/20 0.47

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
SCHEMBL7065739 0.93 GRM2 (0.63) GRM2F10ITGB3PRSS1PRSS2
SCHEMBL7386950 0.92 GRM2 (0.63) GRM2F10ITGB3PRSS1PRSS2
SCHEMBL7064599 0.92 GRM2 (0.64) GRM2F10ITGB3PRSS1PRSS2
SCHEMBL7386353 0.89 GRM2 (0.59) GRM2F10ITGB3PRSS1PRSS2
SCHEMBL7067364 0.89 GRM2 (0.64) GRM2
SCHEMBL7065870 0.87 GRM2 (0.60) GRM2F10ITGB3PRSS1PRSS2
SCHEMBL2823046 0.87 GRM2 (0.90) GRM2
SCHEMBL7067302 0.87 GRM2 (0.57) GRM2F10ITGB3PRSS1PRSS2
SCHEMBL7387162 0.86 GRM2 (0.59) GRM2F10ITGB3PRSS1ITGA2B
SCHEMBL8151677 0.86 GRM2 (0.57) GRM2F10ITGB3PRSS1PRSS2

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