SCHEMBL7008346

SCHEMBL7008346

COc1ccc(S(=O)(=O)N(Cc2ccccc2)c2c(OC(=O)NO)cnc3ccc(C(F)(F)F)cc23)cc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 19/20 0.78
MMP9 P14780 18/20 0.78
MMP1 P03956 18/20 0.78
ADAM17 P78536 10/20 0.59

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
SCHEMBL7006635 0.94 MMP13 (0.78) MMP13MMP9MMP1ADAM17
SCHEMBL7009850 0.90 MMP9 (0.76) MMP13MMP9MMP1ADAM17
SCHEMBL7009343 0.88 MMP13 (1.00) MMP13MMP9MMP1ADAM17
SCHEMBL7015826 0.87 MMP9 (0.79) MMP13MMP9MMP1ADAM17
SCHEMBL7007184 0.86 MMP1 (0.62) MMP13MMP9MMP1ADAM17
SCHEMBL6290541 0.86 MMP13 (0.85) MMP13MMP9MMP1ADAM17
SCHEMBL7005027 0.85 MMP1 (0.76) MMP13MMP9MMP1ADAM17
SCHEMBL7006013 0.84 MMP13 (0.77) MMP13MMP9MMP1ADAM17
Hydroxyamine SCHEMBL7418152 0.84 MMP13 (0.82) MMP13MMP9MMP1ADAM17
SCHEMBL7418158 0.83 MMP13 (0.80) 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