SCHEMBL7076512

SCHEMBL7076512

COc1ccc(N(C)S(=O)(=O)Cc2ccccc2C(=O)NO)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 18/20 0.53
MMP13 P45452 18/20 0.53
MMP1 P03956 16/20 0.53
ADAM17 P78536 9/20 0.53
MMP2 P08253 4/20 0.51
MMP8 P22894 4/20 0.51
MMP12 P39900 4/20 0.51
MMP14 P50281 4/20 0.51
MMP16 P51512 4/20 0.51
MMP3 P08254 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL7076474 0.88 TP53 (0.50) MMP9MMP13MMP1ADAM17L3MBTL1
SCHEMBL7072875 0.86 L3MBTL1 (0.48) MMP13MMP2MMP8MMP12MMP14
SCHEMBL5898955 0.80 MMP9 (0.62) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7072106 0.79 MMP13 (0.64) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7076508 0.77 HTT (0.52) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7076484 0.71 MMP2 (0.67) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL15480646 0.69 HDAC1 (0.53)
SCHEMBL7319166 0.69 MMP9 (1.00) MMP9MMP13MMP1ADAM17MMP12
SCHEMBL7321001 0.69 MMP9 (0.71) MMP9MMP13MMP1ADAM17
SCHEMBL7073806 0.69 CA1 (0.52) MMP9MMP13MMP2MMP8MMP12

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-20030022893-A1 Hydroxamic and carboxylic acid derivatives BAXTER ANDREW DOUGLAS (GB) 2003-01-30 US claimed
US-6465468-B1 SUCH AS N-HYDROXY-2-(4-(4-CHLOROPHENYL)PIPERAZINE-1-SULFONYL)BENZAMIDE; INHIBITORS OF MATRIX METALLOPROTEINASE, ADAM OR ADAMTS ENZYMES; TREATMENT OF DEGENERATIVE DISEASES AND CERTAIN CANCERS DARWIN DISCOVERY LIMITED (GB) 2002-10-15 US claimed
US-20030022893-A1 Hydroxamic and carboxylic acid derivatives BAXTER ANDREW DOUGLAS (GB) 2003-01-30 US disclosed