SCHEMBL6789136

SCHEMBL6789136

O=C(Nc1ccc(S(=O)(=O)CC(CSc2ccccc2)C(=O)NO)cc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
KDM4E B2RXH2 1/20 0.50
PRMT1 Q99873 2/20 0.49
MMP9 P14780 5/20 0.48
MMP2 P08253 4/20 0.48
MMP8 P22894 3/20 0.48
MMP1 P03956 2/20 0.48
MMP3 P08254 2/20 0.48
MMP13 P45452 3/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
HPGD P15428 1/20 0.47
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.44
PPARG P37231 1/20 0.44
NCOA2 Q15596 1/20 0.44
NCOA1 Q15788 1/20 0.44

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
SCHEMBL6789365 0.93 KMT2A (0.48) KMT2AMEN1KDM4EPRMT1MMP9
SCHEMBL7446242 0.93 MMP13 (0.50) KMT2AMEN1KDM4EMMP9MMP2
SCHEMBL6798853 0.90 MMP2 (0.43) KMT2AMEN1KDM4EMMP9MMP2
SCHEMBL6790742 0.90 KMT2A (0.53) KMT2AMEN1KDM4EPRMT1MMP9
SCHEMBL6783924 0.83 KMT2A (0.51) KMT2AMEN1KDM4EPRMT1MMP9
SCHEMBL6789356 0.83 MMP9 (0.53) KMT2AMEN1KDM4EPRMT1MMP9
SCHEMBL6789668 0.81 MMP2 (0.47) KMT2AMEN1KDM4EPRMT1MMP9
SCHEMBL6764979 0.80 PRMT1 (0.57) KMT2AMEN1KDM4EPRMT1MMP9
SCHEMBL6784051 0.80 MMP2 (0.52) MMP9MMP2MMP8MMP1MMP3
SCHEMBL6794449 0.80 MMP13 (0.50) MMP9MMP2MMP8MMP1MMP3

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 3 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