SCHEMBL7076689

SCHEMBL7076689

O=C(Cc1ccccc1S(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)NO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.49
HDAC1 Q13547 3/20 0.49
HDAC3 O15379 2/20 0.49
HDAC4 P56524 2/20 0.49
HDAC7 Q8WUI4 2/20 0.49
HDAC2 Q92769 2/20 0.49
HDAC10 Q969S8 2/20 0.49
HDAC11 Q96DB2 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
HDAC9 Q9UKV0 2/20 0.49
HDAC5 Q9UQL6 2/20 0.49
TP53 P04637 2/20 0.49
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 1/20 0.46
EPHX2 P34913 2/20 0.45
LMNA P02545 1/20 0.45
THRB P10828 1/20 0.45
GAA P10253 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
SCHEMBL7074119 0.91 HDAC3 (0.46) MAPTHDAC1HDAC3HDAC4HDAC7
SCHEMBL7073733 0.87 MAPT (0.49) MAPTTP53MEN1KMT2AHSD11B1
SCHEMBL7074307 0.83 MMP1 (0.44) MAPTHDAC1HDAC3HDAC4HDAC7
SCHEMBL7073728 0.80 MMP2 (0.60) MAPTHDAC1HDAC3HDAC4HDAC7
SCHEMBL7076370 0.80 MMP2 (0.53) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL7072805 0.79 ALDH1A1 (0.56) MAPTHDAC1HDAC3HDAC4HDAC7
SCHEMBL7077437 0.78 MAPT (0.49) MAPTTP53MEN1KMT2AHSD11B1
SCHEMBL7072432 0.78 CNR1 (0.48) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7076740 0.77 EPHX2 (0.51) MAPTHDAC1HDAC3HDAC4HDAC7
SCHEMBL7076735 0.77 EPHX2 (0.51) MAPTHDAC1HDAC3HDAC4HDAC7

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