SCHEMBL7076161

SCHEMBL7076161

CC(=O)N(O)c1ccccc1S(=O)(=O)N(C)Cc1cc2ccccc2o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
RAB9A P51151 3/20 0.39
LMNA P02545 3/20 0.39
NPC1 O15118 2/20 0.39
CLK1 P49759 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
PTGER2 P43116 2/20 0.37
AGXT P21549 1/20 0.36
FLT3 P36888 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL7074387 0.79 ALDH1A1 (0.44) ALDH1A1HPGDKMT2AMEN1LOXL2
SCHEMBL7076158 0.76 MMP2 (0.44) ALDH1A1HPGDKMT2AMEN1RAB9A
SCHEMBL2393157 0.69 LOXL2 (0.53) ALDH1A1HPGDKMT2AMEN1LOXL2
SCHEMBL7076517 0.67 ALDH1A1 (0.44) ALDH1A1HPGDKMT2AMEN1LOXL2
SCHEMBL2396386 0.67 LOXL2 (0.46) ALDH1A1HPGDKMT2AMEN1LOXL2
SCHEMBL28635553 0.66 BCAT2 (0.40) ALDH1A1KMT2ASMN1; SMN2MAPT
Acetic Acid SCHEMBL11341972 0.65 LOXL2 (0.51) ALDH1A1HPGDKMT2AMEN1LOXL2
SCHEMBL7077693 0.65 RAB9A (0.49) ALDH1A1HPGDKMT2AMEN1RAB9A
SCHEMBL7072305 0.65 HDAC3 (0.42) ALDH1A1HPGDKMT2AMEN1RAB9A
SCHEMBL8036021 0.65 ESR1 (0.56) ALDH1A1HPGDKMT2AMEN1LOXL2

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 9 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
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
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
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