SCHEMBL7444559

SCHEMBL7444559

CC1(C)C(=O)NC(=O)N1CC(CS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 16/20 0.48
MMP9 P14780 13/20 0.48
MMP1 P03956 9/20 0.48
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38
MMP13 P45452 1/20 0.38
GAA P10253 1/20 0.37
ADAMTS5 Q9UNA0 2/20 0.36
NPC1 O15118 1/20 0.34

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
SCHEMBL7456663 0.89 MMP2 (0.46) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6788436 0.82 MMP9 (0.55) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6788993 0.80 MMP2 (0.55) MMP2MMP9MMP1MMP3MMP7
SCHEMBL6783922 0.80 MMP2 (0.55) MMP2MMP9MMP1MMP3MMP7
SCHEMBL7456913 0.77 GAA (0.42) MMP2MMP9MMP1MMP3MMP7
SCHEMBL6784130 0.76 MMP2 (0.41) MMP2MMP9MMP1MMP3MMP7
SCHEMBL6783455 0.75 MMP2 (0.43) MMP2MMP9MMP1MMP3MMP7
SCHEMBL6795149 0.74 MMP2 (0.39) MMP2MMP9MMP1MMP3MMP7
SCHEMBL7360995 0.74 NPC1 (0.53) MMP2MMP9MMP1MMP3MMP7
SCHEMBL6790746 0.73 MMP2 (0.42) MMP2MMP9MMP1MMP3MMP7

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 4 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
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