SCHEMBL7320197

SCHEMBL7320197

COc1ccc(S(=O)(=O)CNc2c(C)cc(C#Cc3ccc(-c4ccccc4)cc3)cc2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.46
MMP13 P45452 8/20 0.46
MMP3 P08254 7/20 0.46
MMP1 P03956 6/20 0.46
MMP9 P14780 5/20 0.46
MMP8 P22894 2/20 0.46
SLC16A3 O15427 1/20 0.42
POLB P06746 1/20 0.40
KAT6A Q92794 1/20 0.40
FFAR1 O14842 2/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 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
SCHEMBL7313978 0.94 MMP13 (0.45) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7321489 0.92 MMP13 (0.47) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7322103 0.85 MMP1 (0.44) MMP2MMP13MMP1MMP9POLB
SCHEMBL7322743 0.81 ALDH1A1 (0.39) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7323687 0.81 FFAR4 (0.53) MMP13MMP1MMP9POLBALDH1A1
SCHEMBL7320206 0.80 MMP13 (0.50) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6815491 0.80 MMP13 (0.53) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6815389 0.77 ADAM17 (0.47) MMP2MMP13MMP1MMP9MMP8
SCHEMBL7322284 0.77 MMP13 (0.52) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7313984 0.74 MMP13 (0.51) MMP2MMP13MMP3MMP1MMP9

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