SCHEMBL4289902

SCHEMBL4289902

O=Cc1ccc(S(=O)(=O)Nc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.69
MEN1 O00255 4/20 0.69
PKM P14618 3/20 0.69
ALDH1A1 P00352 1/20 0.69
KEAP1 Q14145 2/20 0.68
IL1RN P18510 1/20 0.68
ERAP1 Q9NZ08 1/20 0.68
CA12 O43570 4/20 0.62
CA9 Q16790 4/20 0.62
CA2 P00918 3/20 0.62
CA1 P00915 2/20 0.62
HDAC3 O15379 2/20 0.60
HDAC4 P56524 2/20 0.60
HDAC1 Q13547 2/20 0.60
HDAC7 Q8WUI4 2/20 0.60
HDAC2 Q92769 2/20 0.60
HDAC10 Q969S8 2/20 0.60
HDAC11 Q96DB2 2/20 0.60
HDAC8 Q9BY41 2/20 0.60
HDAC6 Q9UBN7 2/20 0.60

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
SCHEMBL2163961 0.93 MEN1 (0.69) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL8429131 0.90 UQCRB (0.67) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL14409393 0.84 KMT2A (0.67) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL29549842 0.82 CES1 (0.76) ALDH1A1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28406134 0.82 CES1 (0.76) ALDH1A1HDAC3HDAC4HDAC1HDAC7
SCHEMBL2106251 0.82 CES1 (0.76) ALDH1A1HDAC3HDAC4HDAC1HDAC7
SCHEMBL2802096 0.82 CA1 (0.65) KMT2AMEN1PKMALDH1A1CA2
SCHEMBL20704786 0.82 CA12 (0.64) KMT2AMEN1ALDH1A1CA12CA9
SCHEMBL9001182 0.82 KMT2A (1.00) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL25031372 0.82 KEAP1 (1.00) KMT2AMEN1PKMALDH1A1KEAP1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292593-A2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TopoTarget UK Limited (GB) 2011-03-09 EP disclosed
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 US disclosed
US-7557140-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2009-07-07 US disclosed
CN-101321534-A Benzodiazepines as HCV inhibitors TIBOTEC PHARM LTD (IE) 2008-12-10 CN disclosed
US-7407988-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2008-08-05 US disclosed
US-20080161401-A1 CARBAMIC ACID COMPOUNDS COMPRISING A SULFONAMIDE LINKAGE AS HDAC INHIBITORS TOPOTARGET UK LIMITED (GB) 2008-07-03 US disclosed
US-7183298-B2 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2007-02-27 US disclosed
US-20070004806-A1 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2007-01-04 US disclosed
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 US disclosed
EP-0784612-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-23 EP disclosed
WO-1996010559-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070004806-A1 Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors HDAC1, HDAC11, HDAC3 KMT2A 56/4885MEN1 4252/4885PKM 2037/4885
US-20080161401-A1 CARBAMIC ACID COMPOUNDS COMPRISING A SULFONAMIDE LINKAGE AS HDAC INHIBITORS HDAC1, HDAC11, HDAC3 KMT2A 56/4885MEN1 4252/4885PKM 2037/4885
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS GABRA5, GABRA4, GABRA3 KMT2A 1440/4885MEN1 4829/4885PKM 1177/4885
US-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 KMT2A 3439/4885MEN1 3828/4885PKM 3300/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.