SCHEMBL7553160

SCHEMBL7553160

COC(=O)c1cc(/C=C/C(=O)O)cc(C)c1N(C)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.55
MMP1 P03956 9/20 0.55
MMP9 P14780 9/20 0.55
ADAM17 P78536 8/20 0.55
CYP2C9 P11712 2/20 0.53
THRB P10828 2/20 0.48
HTT P42858 1/20 0.48
ATM Q13315 1/20 0.47
PGR P06401 1/20 0.43
KEAP1 Q14145 2/20 0.42
NFE2L2 Q16236 2/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL7322413 1.00 MMP13 (0.55) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7509306 0.91 MMP9 (0.54) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7319849 0.91 MMP9 (0.54) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7505399 0.87 MMP9 (0.51) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7321309 0.87 MMP9 (0.51) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7317778 0.83 MMP13 (0.66) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7323580 0.83 MMP13 (0.53) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL28744399 0.82 MMP9 (0.53) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL7317053 0.82 MMP9 (0.46) MMP13MMP1MMP9ADAM17CYP2C9
SCHEMBL6810778 0.81 MMP9 (0.81) MMP13MMP1MMP9ADAM17CYP2C9

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 3 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
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
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