SCHEMBL7322746

SCHEMBL7322746

CCCCCCCCCCC#Cc1cc(C)c(N(C)S(=O)(=O)c2ccc(OC)cc2)c(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 14/20 0.51
ADAM17 P78536 14/20 0.51
MMP9 P14780 13/20 0.51
MMP1 P03956 10/20 0.48
CYP2C9 P11712 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
SCHEMBL7324786 0.92 MMP13 (0.52) MMP13ADAM17MMP9MMP1CYP2C9
SCHEMBL7315991 0.90 MMP13 (0.64) MMP13ADAM17MMP9MMP1
SCHEMBL7314656 0.82 MMP13 (0.57) MMP13ADAM17MMP9MMP1
SCHEMBL7322743 0.82 ALDH1A1 (0.39) MMP13ADAM17MMP9MMP1CYP2C9
SCHEMBL7323855 0.82 MMP13 (0.53) MMP13ADAM17MMP9MMP1CYP2C9
SCHEMBL7320206 0.79 MMP13 (0.50) MMP13ADAM17MMP9MMP1CYP2C9
SCHEMBL7324779 0.76 ALDH1A1 (0.38) MMP13ADAM17MMP9MMP1CYP2C9
SCHEMBL7323692 0.76 MMP13 (0.64) MMP13ADAM17MMP9MMP1CYP2C9
SCHEMBL6816584 0.76 ADAM17 (0.83) MMP13ADAM17MMP9MMP1
SCHEMBL6815494 0.76 ADAM17 (0.73) MMP13ADAM17MMP9MMP1

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-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