SCHEMBL6790724

SCHEMBL6790724

O=C(Nc1ccc(S(=O)(=O)CC(CN2C(=O)NC(=O)C2CO)C(=O)O)cc1)c1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 4/20 0.42
MMP2 P08253 3/20 0.42
MMP3 P08254 1/20 0.41
MMP13 P45452 1/20 0.41
PRMT1 Q99873 2/20 0.41
MAPT P10636 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
NPC1 O15118 1/20 0.39
ENPP1 P22413 4/20 0.38
ENPP3 O14638 3/20 0.38
ENPP2 Q13822 3/20 0.37

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
SCHEMBL6795149 0.87 MMP2 (0.39) MMP9MMP2MMP3MMP13
SCHEMBL7451488 0.80 MMP2 (0.42) MMP9MMP2MMP3MMP13PRMT1
SCHEMBL6789912 0.75 MMP2 (0.44) MMP9MMP2MMP3MMP13CA12
SCHEMBL6784130 0.74 MMP2 (0.41) MMP9MMP2MMP3MMP13
SCHEMBL6790296 0.71 ENPP1 (0.54) MMP9MMP2MMP3MMP13PRMT1
SCHEMBL6783924 0.71 KMT2A (0.51) MMP9MMP2MMP3MMP13PRMT1
SCHEMBL7450056 0.71 MMP2 (0.41) MMP9MMP2MMP3MMP13
SCHEMBL6789343 0.70 MMP2 (0.38) MMP9MMP2MMP3MMP13NPC1
SCHEMBL7456835 0.68 MMP2 (0.40) MMP9MMP2MMP3MMP13
SCHEMBL7446724 0.68 MMP2 (0.40) MMP9MMP2MMP3MMP13CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6765003-B1 ANTICARCINOGENIC, ANTITUMOR, AND ANTIMETASTASIS AGENTS; RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, OSTEOPOROSIS, MULTIPLE SCLEROSIS, STROKE, ARTERIOSCLEROSIS, PHARMACIA ITALIA, SPA (IT) 2004-07-20 US 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 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