SCHEMBL7076497

SCHEMBL7076497

O=C(O)Cc1ccccc1S(=O)(=O)N1CCCCC1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.46
POLB P06746 1/20 0.44
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
HTT P42858 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 2/20 0.41
ACLY P53396 1/20 0.41
LMNA P02545 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MGLL Q99685 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL7077521 0.89 POLB (0.46) FKBP1APOLBPSEN1PSEN2APH1B
SCHEMBL7077516 0.77 HTT (0.42) FKBP1APOLBPSEN1PSEN2APH1B
SCHEMBL7125745 0.75 ALDH1A1 (0.45) FKBP1APOLBPSEN1PSEN2APH1B
SCHEMBL14638703 0.73 LTA4H (0.53) HTTSMN1; SMN2ALDH1A1LMNAMGLL
SCHEMBL29317054 0.72 ALDH1A1 (0.59) FKBP1AHTTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL29316045 0.72 ALDH1A1 (0.59) FKBP1AHTTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL7072306 0.71 ACLY (0.57) ACLYMMP2MMP12MMP13
SCHEMBL7073733 0.71 MAPT (0.49) POLBHTTSMN1; SMN2ALDH1A1LMNA
SCHEMBL5578290 0.70 ACLY (0.64) ACLY
SCHEMBL13401706 0.70 MMP2 (0.75) MMP1MMP2MMP3MMP9MMP8

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 5 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-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