SCHEMBL6798853

SCHEMBL6798853

N#Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)CC(CSc3ccccc3)C(=O)NO)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.43
MMP9 P14780 2/20 0.43
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 3/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
POLB P06746 3/20 0.42
MAPT P10636 1/20 0.42
SIRT2 Q8IXJ6 3/20 0.42
KDM4E B2RXH2 1/20 0.41
NAMPT P43490 1/20 0.41
HPGD P15428 1/20 0.41
PPARG P37231 1/20 0.41
NCOA2 Q15596 1/20 0.41
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41

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
SCHEMBL6789668 0.92 MMP2 (0.47) MMP2MMP9KMT2AMEN1NPC1
SCHEMBL6789136 0.90 KMT2A (0.50) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6789365 0.88 KMT2A (0.48) MMP2MMP9MMP1MMP3MMP8
SCHEMBL7446242 0.88 MMP13 (0.50) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6789191 0.87 MMP13 (0.47) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6787274 0.84 MEN1 (0.45) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6790742 0.81 KMT2A (0.53) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6783924 0.79 KMT2A (0.51) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6789356 0.79 MMP9 (0.53) MMP2MMP9KMT2AMEN1NPC1
SCHEMBL6789958 0.77 MMP2 (0.48) MMP2MMP9MMP3MMP13KMT2A

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
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