SCHEMBL8521996

SCHEMBL8521996

COc1ccc(S(=O)(=O)N(Cc2ccccc2)c2cscc2C(=O)ON)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 11/20 0.56
MMP13 P45452 9/20 0.56
MMP1 P03956 9/20 0.56
LMNA P02545 3/20 0.54
NR3C1 P04150 1/20 0.54
PGR P06401 1/20 0.54
ALDH1A1 P00352 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ADAM17 P78536 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MAPT P10636 1/20 0.51
MMP12 P39900 1/20 0.51
PTGES O14684 1/20 0.50
TAS2R14 Q9NYV8 1/20 0.50
TAS2R8 Q9NYW2 1/20 0.50
CXCR3 P49682 1/20 0.50
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49

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
SCHEMBL6559726 0.92 MMP9 (0.61) MMP9MMP13MMP1LMNANR3C1
Hydroxyamine SCHEMBL8521994 0.89 MMP9 (0.58) MMP9MMP13MMP1LMNANR3C1
SCHEMBL6559408 0.89 MMP9 (0.60) MMP9MMP13MMP1LMNANR3C1
SCHEMBL7461832 0.85 MMP9 (0.73) MMP9MMP13MMP1ADAM17MMP12
SCHEMBL7453335 0.80 MMP9 (0.68) MMP9MMP13MMP1LMNANR3C1
SCHEMBL8521983 0.79 MMP9 (0.58) MMP9MMP13MMP1LMNANR3C1
SCHEMBL8577457 0.78 MMP9 (0.76) MMP9MMP13MMP1LMNANR3C1
SCHEMBL27569110 0.78 MMP13 (0.70) MMP9MMP13MMP1LMNANR3C1
SCHEMBL7460437 0.78 MMP9 (0.60) MMP9MMP13MMP1LMNANR3C1
SCHEMBL6561278 0.78 MMP9 (0.61) MMP9MMP13MMP1LMNANR3C1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934300-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-08-11 EP disclosed
WO-1998016520-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO disclosed