SCHEMBL7076489

SCHEMBL7076489

COc1ccc(CNS(=O)(=O)c2ccccc2CC(=O)NO)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 7/20 0.68
MMP2 P08253 6/20 0.68
MMP9 P14780 5/20 0.68
MMP14 P50281 5/20 0.68
MMP8 P22894 5/20 0.68
MMP13 P45452 5/20 0.68
MMP16 P51512 4/20 0.68
MMP1 P03956 3/20 0.68
MMP3 P08254 3/20 0.68
ADAM17 P78536 1/20 0.68
NSD2 O96028 2/20 0.54
ALDH1A1 P00352 3/20 0.53
HTT P42858 1/20 0.52
TSHR P16473 1/20 0.51
CNR1 P21554 2/20 0.49
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
NPC1 O15118 1/20 0.49

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
SCHEMBL7072853 0.89 MMP2 (0.63) MMP12MMP2MMP9MMP14MMP8
SCHEMBL7072113 0.81 MMP2 (0.63) MMP12MMP2MMP9MMP14MMP8
SCHEMBL7072077 0.79 CA12 (0.74) NSD2ALDH1A1HTTTSHRCNR1
SCHEMBL7073805 0.79 CA9 (0.58) NSD2ALDH1A1HTTTSHRCNR1
SCHEMBL7076484 0.77 MMP2 (0.67) MMP12MMP2MMP9MMP14MMP8
SCHEMBL6483736 0.77 NSD2 (0.76) NSD2ALDH1A1HTTTSHRCNR1
SCHEMBL29206978 0.76 MMP2 (0.51) MMP12MMP2MMP9MMP14MMP8
SCHEMBL31370874 0.75 SMN1; SMN2 (0.49) NSD2ALDH1A1TSHREGFRERBB2
SCHEMBL30714118 0.75 SMN1; SMN2 (0.49) NSD2ALDH1A1TSHREGFRERBB2
SCHEMBL8359828 0.74 NSD2 (0.58) NSD2ALDH1A1HTTTSHRCNR1

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
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
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
EP-1163213-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES Darwin Discovery Limited (GB) 2001-12-19 EP disclosed
WO-2000056704-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES DARWIN DISCOVERY LIMITED (GB) 2000-09-28 WO disclosed