SCHEMBL7575726

SCHEMBL7575726

COc1ccc(S(=O)(=O)C(Nc2c(C)cc(/C=C/C(=O)N(C)C)cc2C(=O)O)c2cccnc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 8/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TBXAS1 P24557 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A1 P04798 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP1B1 Q16678 2/20 0.37
MMP1 P03956 3/20 0.37
MMP9 P14780 3/20 0.37
MMP13 P45452 3/20 0.37
ADAM17 P78536 3/20 0.37
KCNA5 P22460 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL7828604 0.92 MMP9 (0.44) NAMPTMEN1KMT2AMMP1MMP9
SCHEMBL7445487 0.92 MMP9 (0.44) NAMPTMEN1KMT2AMMP1MMP9
SCHEMBL7820315 0.90 MEN1 (0.41) NAMPTMEN1KMT2ATBXAS1SMN1; SMN2
SCHEMBL7554898 0.89 TRPM8 (0.42) NAMPTMEN1KMT2ATBXAS1MMP1
SCHEMBL7510775 0.85 MMP1 (0.47) TBXAS1LMNASMN1; SMN2MMP1MMP9
SCHEMBL7511843 0.83 MMP1 (0.49) TBXAS1MMP1MMP9MMP13ADAM17
SCHEMBL7823959 0.83 MMP9 (0.43) NAMPTMEN1KMT2ASMN1; SMN2MMP1
SCHEMBL7566474 0.83 MMP9 (0.43) NAMPTMEN1KMT2ASMN1; SMN2MMP1
SCHEMBL7451074 0.83 MMP13 (0.43) MEN1KMT2AMMP1MMP9MMP13
SCHEMBL7824531 0.83 MMP13 (0.43) MEN1KMT2AMMP1MMP9MMP13

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