SCHEMBL7072073

SCHEMBL7072073

COc1ccc(N(C)S(=O)(=O)c2ccccc2C(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.54
FABP4 P15090 1/20 0.50
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 3/20 0.46
USP2 O75604 1/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP12 P39900 1/20 0.45
MMP13 P45452 1/20 0.45
MMP14 P50281 1/20 0.45
MMP16 P51512 1/20 0.45
GFER P55789 1/20 0.45

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
SCHEMBL7073806 0.88 CA1 (0.52) PGRL3MBTL1MAPTKDM4EALDH1A1
SCHEMBL7072106 0.85 MMP13 (0.64) PGRL3MBTL1MAPTKDM4EALDH1A1
SCHEMBL8048444 0.81 FABP4 (0.46) PGRFABP4ALDH1A1MEN1KMT2A
SCHEMBL7072859 0.80 MMP2 (0.64) PGRL3MBTL1MAPTKDM4EALDH1A1
SCHEMBL6349297 0.79 MCOLN3 (0.46) PGRMAPTKDM4EALDH1A1KMT2A
SCHEMBL7072875 0.77 L3MBTL1 (0.48) PGRL3MBTL1MEN1KMT2ALMNA
SCHEMBL1614969 0.77 TAS2R14 (0.66)
SCHEMBL7076487 0.77 PGR (0.50) PGRL3MBTL1MAPTKDM4EALDH1A1
SCHEMBL10186886 0.77 L3MBTL1 (0.83) PGRL3MBTL1MAPTKDM4EALDH1A1
SCHEMBL5515234 0.75 MCL1 (0.59) FABP4ALDH1A1MMP2MMP9MMP8

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003525203-A 2003-08-26 JP claimed
US-20030022893-A1 Hydroxamic and carboxylic acid derivatives BAXTER ANDREW DOUGLAS (GB) 2003-01-30 US claimed
EP-1163213-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES Darwin Discovery Limited (GB) 2001-12-19 EP claimed
WO-2000056704-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES DARWIN DISCOVERY LIMITED (GB) 2000-09-28 WO claimed
US-20030022893-A1 Hydroxamic and carboxylic acid derivatives BAXTER ANDREW DOUGLAS (GB) 2003-01-30 US disclosed
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 disclosed