SCHEMBL7013255

SCHEMBL7013255

CN(c1c(OC(=O)NO)cnc2ccc(I)cc12)S(=O)(=O)c1ccc(Oc2ccncc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 15/20 0.58
MMP1 P03956 15/20 0.58
MMP9 P14780 13/20 0.58
ADAM17 P78536 10/20 0.58
MMP2 P08253 1/20 0.33

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
SCHEMBL7004353 0.86 MMP13 (0.78) MMP13MMP1MMP9ADAM17
Hydrochloric Acid SCHEMBL7007676 0.85 MMP13 (0.77) MMP13MMP1MMP9ADAM17
SCHEMBL7010815 0.83 MMP13 (0.62) MMP13MMP1MMP9ADAM17
SCHEMBL7014631 0.80 MMP13 (0.52) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL7006547 0.76 MMP9 (0.54) MMP13MMP1MMP9ADAM17
SCHEMBL7009856 0.75 MMP9 (0.55) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL7012919 0.75 MMP9 (0.76) MMP13MMP1MMP9ADAM17
SCHEMBL7006362 0.75 MMP1 (0.53) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL7010946 0.72 MMP13 (0.59) MMP13MMP1MMP9ADAM17
SCHEMBL7006372 0.70 MMP13 (0.51) MMP13MMP1MMP9ADAM17MMP2

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