SCHEMBL6790296

SCHEMBL6790296

O=C(Nc1ccc(S(=O)(=O)CC(COc2ccccc2)C(=O)O)cc1)c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 4/20 0.54
ENPP3 O14638 3/20 0.54
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
MMP2 P08253 3/20 0.51
MMP3 P08254 2/20 0.51
MMP13 P45452 2/20 0.51
PRMT1 Q99873 2/20 0.50
MMP9 P14780 1/20 0.49
TP53 P04637 1/20 0.47
ENPP2 Q13822 3/20 0.47
MAPT P10636 1/20 0.46
HSD17B10 Q99714 1/20 0.46
P2RY2 P41231 1/20 0.46
GPR17 Q13304 1/20 0.46
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
ALDH1A1 P00352 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL6784814 0.92 PRMT1 (0.52) MEN1KMT2AMMP2MMP3MMP13
SCHEMBL6789417 0.91 ENPP1 (0.51) ENPP1ENPP3MEN1KMT2AMMP2
SCHEMBL6789427 0.90 ENPP1 (0.48) ENPP1ENPP3MEN1KMT2AMMP2
SCHEMBL6783079 0.89 MMP2 (0.58) MEN1KMT2AMMP2MMP3MMP13
SCHEMBL6789958 0.88 MMP2 (0.48) MEN1KMT2AMMP2MMP3MMP13
SCHEMBL6788751 0.84 PPARG (0.50) MMP2MMP9BCL2L1MCL1
SCHEMBL6787286 0.82 KMT2A (0.53) MEN1KMT2AMAPT
SCHEMBL7447715 0.82 KMT2A (0.53) MEN1KMT2AMAPT
SCHEMBL6783924 0.81 KMT2A (0.51) ENPP1ENPP3MEN1KMT2AMMP2
SCHEMBL7450556 0.80 MEN1 (0.44) MEN1KMT2AMMP2MMP3MMP13

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