SCHEMBL7055853

SCHEMBL7055853

COc1ccc(S(=O)(=O)N(CC(C)C)C(CCSCc2ccccc2)C(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 17/20 0.74
MMP2 P08253 17/20 0.74
MMP9 P14780 17/20 0.74
MMP13 P45452 15/20 0.73
MMP1 P03956 9/20 0.70
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51

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
SCHEMBL8041322 0.94 MMP3 (0.84) MMP3MMP2MMP9MMP13MMP1
SCHEMBL8046516 0.94 MMP2 (0.84) MMP3MMP2MMP9MMP13MMP1
SCHEMBL8039441 0.92 MMP3 (0.75) MMP3MMP2MMP9MMP13MMP1
SCHEMBL9247824 0.91 MMP3 (0.90) MMP3MMP2MMP9MMP13MMP1
SCHEMBL7053893 0.91 MMP3 (0.90) MMP3MMP2MMP9MMP13MMP1
SCHEMBL7053227 0.89 MMP3 (0.81) MMP3MMP2MMP9MMP13MMP1
SCHEMBL7052106 0.88 MMP3 (0.74) MMP3MMP2MMP9MMP13MMP1
SCHEMBL8046789 0.87 MMP3 (0.84) MMP3MMP2MMP9MMP13MMP1
SCHEMBL8029681 0.86 MMP2 (0.85) MMP3MMP2MMP9MMP13MMP1
SCHEMBL7055373 0.85 MMP3 (1.00) MMP3MMP2MMP9MMP13MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0979816-B1 Hydroxamic acid derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-05-02 EP disclosed
US-6063816-A Hydroxamic acid compounds ADIR ET COMPAGNIE (FR) 2000-05-16 US disclosed
EP-0979816-A1 Hydroxamic acid derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-02-16 EP disclosed