SCHEMBL7318045

SCHEMBL7318045

COc1ccc(S(=O)(=O)N(Cc2cccnc2)c2c(OCc3cccnc3)cccc2C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 19/20 0.63
MMP13 P45452 19/20 0.63
MMP1 P03956 18/20 0.63
ADAM17 P78536 16/20 0.63
KEAP1 Q14145 1/20 0.61
NFE2L2 Q16236 1/20 0.61

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
SCHEMBL7314648 0.92 MMP9 (0.75) MMP9MMP13MMP1ADAM17KEAP1
SCHEMBL27511006 0.91 MMP9 (0.75) MMP9MMP13MMP1ADAM17
SCHEMBL7322105 0.88 MMP9 (0.69) MMP9MMP13MMP1ADAM17KEAP1
SCHEMBL7311162 0.87 MMP9 (0.81) MMP9MMP13MMP1ADAM17
SCHEMBL7451383 0.86 MMP9 (0.83) MMP9MMP13MMP1ADAM17
SCHEMBL7449515 0.85 MMP9 (0.86) MMP9MMP13MMP1ADAM17
SCHEMBL7504340 0.83 MMP9 (0.70) MMP9MMP13MMP1ADAM17
SCHEMBL7448977 0.83 MMP9 (0.64) MMP9MMP13MMP1ADAM17KEAP1
SCHEMBL7317808 0.82 MMP9 (0.81) MMP9MMP13MMP1ADAM17
SCHEMBL7314677 0.81 MMP9 (0.72) MMP9MMP13MMP1ADAM17KEAP1

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
EP-0938471-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2001-12-12 EP disclosed
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed