SCHEMBL7316088

SCHEMBL7316088

COc1ccc(S(=O)(=O)CNc2c(C)cc(/C=C/C(=O)N(C)C)cc2C(=O)NO)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 15/20 0.45
MMP1 P03956 15/20 0.45
MMP9 P14780 14/20 0.45
ADAM17 P78536 7/20 0.45
PTGS2 P35354 1/20 0.42
MMP12 P39900 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MMP2 P08253 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
MMP16 P51512 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL7820104 1.00 MMP13 (0.45) MMP13MMP1MMP9ADAM17PTGS2
SCHEMBL7319845 0.91 PTGS2 (0.41) MMP13MMP1MMP9ADAM17PTGS2
SCHEMBL7323574 0.91 LMNA (0.43) MMP13MMP1MMP9ADAM17PTGS2
SCHEMBL7820002 0.87 PTGS2 (0.41) MMP13MMP1MMP9ADAM17PTGS2
SCHEMBL7830182 0.85 TRPM8 (0.48) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7453309 0.84 MEN1 (0.44) MMP13MMP1MMP9ADAM17PTGS2
SCHEMBL7830179 0.84 MMP13 (0.38) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7318219 0.83 MMP13 (0.56) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL6815791 0.81 MMP13 (0.60) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7316093 0.81 MMP13 (0.69) MMP13MMP1MMP9ADAM17

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 7 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 claimed
EP-0938471-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-09-01 EP claimed
WO-1998016503-A2 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO claimed
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
EP-0938471-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-09-01 EP disclosed
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed
WO-1998016503-A2 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO disclosed