SCHEMBL7012575

SCHEMBL7012575

COc1ccc(S(=O)(=O)N(Cc2cccnc2)c2c(OC(=O)NO)cnc3c(-c4cccs4)cccc23)cc1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.80
MMP9 P14780 19/20 0.80
MMP1 P03956 19/20 0.80
ADAM17 P78536 18/20 0.80

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
SCHEMBL7013619 0.89 MMP13 (1.00) MMP13MMP9MMP1ADAM17
SCHEMBL7006168 0.89 MMP13 (0.79) MMP13MMP9MMP1ADAM17
SCHEMBL7008539 0.88 MMP13 (0.77) MMP13MMP9MMP1ADAM17
SCHEMBL7012090 0.88 MMP13 (0.79) MMP13MMP9MMP1ADAM17
SCHEMBL7352698 0.86 MMP13 (0.85) MMP13MMP9MMP1ADAM17
SCHEMBL7010310 0.86 MMP13 (0.78) MMP13MMP9MMP1ADAM17
SCHEMBL7011410 0.84 MMP13 (0.79) MMP13MMP9MMP1ADAM17
SCHEMBL7460086 0.80 MMP9 (0.75) MMP13MMP9MMP1ADAM17
SCHEMBL7015101 0.79 MMP1 (0.76) MMP13MMP9MMP1ADAM17
SCHEMBL7009764 0.79 MMP1 (0.77) MMP13MMP9MMP1ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021413-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO BICYCLIC HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS WYETH CORP (US) 2003-06-11 EP claimed