SCHEMBL7345291

SCHEMBL7345291

COc1ccc(S(=O)(=O)N2CC[S+]([O-])CC2C(=O)NO)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 20/20 0.67
▸ MMP3 P08254 17/20 0.67
▸ MMP13 P45452 14/20 0.67
▸ MMP7 P09237 14/20 0.67
▸ MMP9 P14780 11/20 0.65
▸ MMP2 P08253 2/20 0.64
▸ MMP8 P22894 2/20 0.64
▸ ADAM17 P78536 1/20 0.62

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
SCHEMBL7339164 0.87 MMP1 (0.51) MMP1MMP3MMP13MMP7MMP9
SCHEMBL6269273 0.86 MMP3 (0.63) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7349862 0.82 MMP1 (0.91) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7763139 0.81 MMP1 (0.98) MMP1MMP3MMP13MMP7MMP9
SCHEMBL6981692 0.80 MMP1 (1.00) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7393667 0.80 MMP1 (1.00) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7413344 0.80 MMP1 (1.00) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7533064 0.78 MMP1 (0.91) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7533059 0.78 MMP1 (0.91) MMP1MMP3MMP13MMP7MMP9
SCHEMBL6394072 0.78 MMP1 (0.76) MMP1MMP3MMP13MMP7MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0923563-A1 1,4-HETEROCYCLIC METALLPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1999-06-23 — — EP disclosed
WO-1998008825-A1 1,4-HETEROCYCLIC METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1998-03-05 — — WO disclosed
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