SCHEMBL7355753

SCHEMBL7355753

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(CC(CC(N)=O)C(N)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 12/20 0.49
FEN1 P39748 12/20 0.49
MMP3 P08254 1/20 0.45
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
EDNRB P24530 1/20 0.40
EDNRA P25101 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40

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
SCHEMBL7355759 1.00 ALOX5AP (0.49) ALOX5APFEN1MMP3OPRM1OPRK1
SCHEMBL6974699 0.82 ALOX5AP (0.53) ALOX5APFEN1MMP3OPRM1OPRK1
SCHEMBL6771873 0.80 EDNRA (0.58) ALOX5APFEN1OPRM1OPRK1EDNRB
SCHEMBL7190899 0.78 ALOX5AP (0.55) ALOX5APFEN1MMP3OPRM1OPRK1
SCHEMBL7350035 0.77 MME (0.50) MMP1MMP9
SCHEMBL6630002 0.77 ALOX5AP (0.57) ALOX5APFEN1OPRM1OPRK1
SCHEMBL7355749 0.76 SCN9A (0.48) ALOX5APFEN1MMP3OPRM1OPRK1
SCHEMBL8429813 0.75 ALOX5AP (0.54) ALOX5APFEN1
SCHEMBL7352933 0.74 MME (0.50) MMP2MMP9
SCHEMBL7266847 0.74 ALOX5AP (0.55) ALOX5APFEN1MMP3OPRM1OPRK1

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
EP-1005448-A2 NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS Du Pont Pharmaceuticals Company (US) 2000-06-07 EP claimed
WO-1999009000-A2 NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS DU PONT PHARMACEUTICALS COMPANY (US) 1999-02-25 WO claimed
EP-1005448-A2 NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS Du Pont Pharmaceuticals Company (US) 2000-06-07 EP disclosed
WO-1999009000-A2 NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS DU PONT PHARMACEUTICALS COMPANY (US) 1999-02-25 WO disclosed