SCHEMBL7004398

SCHEMBL7004398

COc1ccc(S(=O)(=O)N(Cc2cccnc2)c2c(OC(=O)NO)cnc3c2cnn3Cc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 20/20 0.64
MMP13 P45452 20/20 0.64
MMP1 P03956 19/20 0.64
ADAM17 P78536 18/20 0.64

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
Hydrochloric Acid SCHEMBL7008500 0.89 MMP9 (0.78) MMP9MMP13MMP1ADAM17
SCHEMBL7012171 0.86 MMP9 (0.69) MMP9MMP13MMP1ADAM17
Hydroxyamine SCHEMBL7538525 0.85 MMP9 (0.67) MMP9MMP13MMP1ADAM17
SCHEMBL7010199 0.83 MMP9 (0.69) MMP9MMP13MMP1ADAM17
SCHEMBL7013016 0.82 MMP9 (0.79) MMP9MMP13MMP1ADAM17
SCHEMBL7012090 0.82 MMP13 (0.79) MMP9MMP13MMP1ADAM17
SCHEMBL7008539 0.82 MMP13 (0.77) MMP9MMP13MMP1ADAM17
SCHEMBL7006168 0.82 MMP13 (0.79) MMP9MMP13MMP1ADAM17
SCHEMBL7011410 0.82 MMP13 (0.79) MMP9MMP13MMP1ADAM17
SCHEMBL7012033 0.82 MMP9 (0.57) MMP9MMP13MMP1ADAM17

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