SCHEMBL7076239

SCHEMBL7076239

O=C(NO)c1ccccc1S(=O)(=O)N1CCN(c2cc(Cl)cc(Cl)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.60
MMP13 P45452 8/20 0.60
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.47
HDAC3 O15379 3/20 0.47
HDAC4 P56524 3/20 0.47
HDAC1 Q13547 3/20 0.47
HDAC7 Q8WUI4 3/20 0.47
HDAC2 Q92769 3/20 0.47
HDAC10 Q969S8 3/20 0.47
HDAC11 Q96DB2 3/20 0.47
HDAC8 Q9BY41 3/20 0.47
HDAC6 Q9UBN7 3/20 0.47
HDAC9 Q9UKV0 3/20 0.47
HDAC5 Q9UQL6 3/20 0.47
ACLY P53396 1/20 0.46
LMNA P02545 2/20 0.45
THRB P10828 1/20 0.45
MCL1 Q07820 1/20 0.45
TP53 P04637 2/20 0.44

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
SCHEMBL7073728 0.90 MMP2 (0.60) MMP2MMP13MAPTHDAC3HDAC4
SCHEMBL12150842 0.87 MMP2 (0.69) MMP2MMP13MAPTHDAC3HDAC4
SCHEMBL7074361 0.86 MCL1 (0.56) MMP2MMP13MAPTACLYLMNA
SCHEMBL7077701 0.84 MAPT (0.54) MAPTPOLBACLYLMNATP53
SCHEMBL7074119 0.80 HDAC3 (0.46) MMP2MMP13MAPTPOLBHDAC3
SCHEMBL7077191 0.78 MMP2 (0.54) MMP2MMP13HDAC3HDAC4HDAC1
SCHEMBL7079810 0.77 ALDH1A1 (0.59) MMP2MMP13MAPTPOLBHDAC3
SCHEMBL7076380 0.76 MCL1 (0.56) MAPTHDAC3HDAC4HDAC1HDAC7
SCHEMBL7072432 0.76 CNR1 (0.48) MAPTPOLBACLYLMNATHRB
SCHEMBL5898957 0.75 MMP2 (1.00) MMP2MMP13POLBLMNA

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