SCHEMBL6790714

SCHEMBL6790714

O=C(O)C(COc1cccc(F)c1)CS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.47
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
TRPV4 Q9HBA0 1/20 0.41
MMP13 P45452 2/20 0.41
ALDH1A1 P00352 1/20 0.39
MMP2 P08253 3/20 0.38
MMP9 P14780 2/20 0.38
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
HSD17B10 Q99714 1/20 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
SCHEMBL6788751 0.88 PPARG (0.50) PPARGPPARAMMP2MMP9MMP7
SCHEMBL6787277 0.87 ALDH1A1 (0.46) ADAMTS4TRPV4MMP13ALDH1A1MMP2
SCHEMBL6789427 0.86 ENPP1 (0.48) MMP13ALDH1A1MMP2MMP9MMP3
SCHEMBL6794038 0.83 BCL2L1 (0.47) ADAMTS4MMP13MMP2MMP9MMP1
SCHEMBL6783348 0.77 BCL2L1 (0.49) PPARGPPARAMMP13MMP2MMP9
SCHEMBL6787286 0.77 KMT2A (0.53) ADAMTS4
SCHEMBL7447715 0.77 KMT2A (0.53) ADAMTS4
SCHEMBL6783697 0.75 CYP1A2 (0.45) MMP2MMP9MMP1MMP3MMP7
SCHEMBL7450556 0.75 MEN1 (0.44) MMP13ALDH1A1MMP2MMP9MMP3
SCHEMBL6788518 0.74 ALDH1A1 (0.53) ADAMTS4MMP13ALDH1A1MMP2MMP9

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