SCHEMBL6788993

SCHEMBL6788993

CN1C(=O)N(CC(CS(=O)(=O)c2ccc(-c3ccc(Cl)cc3)cc2)C(=O)O)C(=O)C1(C)C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 17/20 0.55
MMP9 P14780 12/20 0.55
MMP1 P03956 9/20 0.55
MMP3 P08254 2/20 0.39
MMP13 P45452 2/20 0.39
NPC1 O15118 1/20 0.39
MMP7 P09237 1/20 0.37
TP53 P04637 1/20 0.37
MDM2 Q00987 1/20 0.37
GAA P10253 1/20 0.36

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
SCHEMBL6783922 1.00 MMP2 (0.55) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6788586 0.91 MMP2 (0.47) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6784899 0.89 MMP2 (0.53) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6788436 0.85 MMP9 (0.55) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6790746 0.81 MMP2 (0.42) MMP2MMP9MMP1MMP3MMP13
SCHEMBL1380533 0.80 MMP2 (0.54) MMP2MMP9MMP1MMP3MMP13
SCHEMBL1380534 0.80 MMP2 (0.54) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7444559 0.80 MMP2 (0.48) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6788599 0.80 MMP2 (0.47) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6789040 0.77 GAA (0.42) MMP2MMP9MMP1MMP3MMP13

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
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
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