SCHEMBL7444935

SCHEMBL7444935

CCCCCCCCN(c1c(CO)cccc1C(=O)OC)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 10/20 0.47
MMP1 P03956 8/20 0.47
MMP13 P45452 8/20 0.47
ADAM17 P78536 5/20 0.47
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 1/20 0.45
BMP1 P13497 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CNR2 P34972 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP2 P08253 1/20 0.44
CA9 Q16790 1/20 0.44
KEAP1 Q14145 4/20 0.43
NFE2L2 Q16236 4/20 0.43
LMNA P02545 1/20 0.41

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
SCHEMBL7506665 0.85 MMP9 (0.47) MMP9MMP1MMP13ADAM17KDM4E
SCHEMBL7817619 0.85 MMP1 (0.61) MMP9MMP1MMP13ADAM17
SCHEMBL7825425 0.77 MMP9 (0.77) MMP9MMP1MMP13ADAM17
SCHEMBL7444339 0.77 MMP1 (0.74) MMP9MMP1MMP13ADAM17
SCHEMBL7315173 0.75 MMP9 (0.62) MMP9MMP1MMP13ADAM17KDM4E
SCHEMBL7320832 0.73 MMP1 (0.50) MMP9MMP1MMP13ADAM17KDM4E
SCHEMBL7311421 0.72 MMP1 (0.81) MMP9MMP1MMP13ADAM17KDM4E
SCHEMBL5624488 0.72 ALDH1A1 (0.60) BMP1L3MBTL1CNR2KEAP1NFE2L2
SCHEMBL7444659 0.71 MMP13 (0.59) MMP9MMP1MMP13ADAM17KEAP1
SCHEMBL7317053 0.70 MMP9 (0.46) MMP9MMP1MMP13ADAM17KDM4E

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