SCHEMBL6784512

SCHEMBL6784512

CC(=O)Nc1ccccc1OCC(CS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 1/20 0.48
BRD4 O60885 1/20 0.46
ABCB11 O95342 1/20 0.44
LMNA P02545 6/20 0.43
GAA P10253 3/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KMT2A Q03164 2/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ADAMTS5 Q9UNA0 2/20 0.40
MMP2 P08253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
APAF1 O14727 1/20 0.39
POLB P06746 1/20 0.39
GRK2 P25098 1/20 0.39

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
SCHEMBL6790698 0.87 BRD4 (0.43) SMN1; SMN2MAPTBRD4LMNAGAA
SCHEMBL6783697 0.82 CYP1A2 (0.45) GAACYP1A2CYP2C19TDP1NPC1
SCHEMBL6788751 0.81 PPARG (0.50) GAACYP1A2CYP2C19TDP1ADAMTS5
SCHEMBL6787286 0.81 KMT2A (0.53) SMN1; SMN2MAPTLMNAGAACYP1A2
SCHEMBL7447715 0.81 KMT2A (0.53) SMN1; SMN2MAPTLMNAGAACYP1A2
SCHEMBL6789920 0.77 MMP2 (0.45) SMN1; SMN2MAPTLMNAGAAKMT2A
SCHEMBL6783348 0.73 BCL2L1 (0.49) MMP2MMP9
SCHEMBL6790714 0.73 ADAMTS4 (0.47) ALDH1A1ADAMTS5MMP2MMP9
SCHEMBL6794038 0.72 BCL2L1 (0.47) MMP2MMP9
SCHEMBL6790296 0.72 ENPP1 (0.54) MAPTKMT2ARAB9AMEN1NPC1

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