SCHEMBL13570528

SCHEMBL13570528

CCCC(=O)ON(Cc1cccnc1)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 16/20 0.55
MMP2 P08253 3/20 0.55
ALDH1A1 P00352 1/20 0.52
MMP13 P45452 12/20 0.52
MMP1 P03956 11/20 0.52
ADAM17 P78536 10/20 0.52
CXCR3 P49682 1/20 0.50
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48

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
SCHEMBL26770427 0.76 ALDH1A1 (0.73) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL13570527 0.76 ALDH1A1 (0.63) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL8843296 0.75 TAS2R14 (0.58) KEAP1NFE2L2
SCHEMBL13570529 0.75 MMP9 (0.80) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL13570600 0.75 MMP9 (0.80) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL13570580 0.75 MMP9 (0.80) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL13640701 0.74 MMP9 (0.69) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL13639279 0.74 MMP9 (0.69) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL16330734 0.74 MMP9 (0.61) MMP9MMP2ALDH1A1MMP13MMP1
SCHEMBL16330733 0.74 MMP9 (0.61) MMP9MMP2ALDH1A1MMP13MMP1

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-2520573-A1 Compounds with matrix-metalloproteinase inhibitory activity Westfälische Wilhelms-Universität Münster (DE) 2012-11-07 EP disclosed