SCHEMBL6794032

SCHEMBL6794032

Cc1coc(SCC(CS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)C(=O)O)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.39
MMP9 P14780 5/20 0.39
MMP3 P08254 4/20 0.39
MMP13 P45452 3/20 0.39
MMP1 P03956 2/20 0.39
MMP8 P22894 1/20 0.39
ALDH1A1 P00352 2/20 0.37
HSP90AA1 P07900 1/20 0.37
MMP7 P09237 1/20 0.37
ADAMTS5 Q9UNA0 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
HSD11B1 P28845 1/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PTGS2 P35354 1/20 0.34
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL6783258 0.83 HPGD (0.44) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7447846 0.83 HPGD (0.44) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6789943 0.80 ALDH1A1 (0.43) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6788329 0.80 HPGD (0.39) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6783185 0.78 MMP2 (0.62) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6796186 0.78 MMP2 (0.62) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6783118 0.78 MMP2 (0.62) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6790067 0.78 CA12 (0.51) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL6784835 0.78 MMP2 (0.41) MMP2MMP9MMP3MMP13MMP1
SCHEMBL6789762 0.77 ALDH1A1 (0.48) MMP2MMP9MMP3MMP13MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200398-A1 3-ARYLSULFONYL-2-(SUBSTITUTED METHYL)PROPANOIC ACID DERIVATES AS MATRIX METALLOPROTEINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2002-05-02 EP claimed
WO-2001005756-A1 3-ARYLSULFONYL-2-(SUBSTITUTED METHYL)PROPANOIC ACID DERIVATES AS MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN SPA (IT) 2001-01-25 WO claimed
US-6765003-B1 ANTICARCINOGENIC, ANTITUMOR, AND ANTIMETASTASIS AGENTS; RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, OSTEOPOROSIS, MULTIPLE SCLEROSIS, STROKE, ARTERIOSCLEROSIS, PHARMACIA ITALIA, SPA (IT) 2004-07-20 US disclosed
EP-1200398-A1 3-ARYLSULFONYL-2-(SUBSTITUTED METHYL)PROPANOIC ACID DERIVATES AS MATRIX METALLOPROTEINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2002-05-02 EP disclosed
WO-2001005756-A1 3-ARYLSULFONYL-2-(SUBSTITUTED METHYL)PROPANOIC ACID DERIVATES AS MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN SPA (IT) 2001-01-25 WO disclosed