SCHEMBL1266941

SCHEMBL1266941

O=C(O)c1cc(=O)n(-c2cc(Cl)c(S(=O)(=O)O)cc2Cl)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 17/20 0.49
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CTSA P10619 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL11121976 0.90 ALKBH5 (0.50) ALKBH5ALDH1A1KDM4ECTSA
SCHEMBL8990040 0.86 ALDH1A1 (0.43) ALKBH5ALDH1A1KDM4ECTSAMEN1
SCHEMBL10956802 0.84 ALKBH5 (0.58) ALKBH5ALDH1A1KDM4ECTSA
SCHEMBL8990086 0.82 ALDH1A1 (0.58) ALDH1A1KDM4ECTSAMEN1LMNA
SCHEMBL692667 0.81 MAPT (0.52) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL10400766 0.81 KDM4E (0.33) ALDH1A1KDM4E
SCHEMBL6053229 0.81 KDM4E (0.30) ALDH1A1KDM4E
SCHEMBL1266657 0.80 ALKBH5 (0.51) ALKBH5ALDH1A1KDM4ECTSA
SCHEMBL9786518 0.78 NOX4 (0.44) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL8990138 0.78 ATAD2 (0.36) ALDH1A1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7988740-B2 Keratin dyeing compositions comprising a radical scavenger and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-08-02 US claimed
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof NOXELL CORPORATION 2011-02-17 US claimed
US-7988740-B2 Keratin dyeing compositions comprising a radical scavenger and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-08-02 US disclosed
US-7902144-B2 Carrier-molecule-affinitive substance which has an association constant KA relative to a carrier molecule greater than 103 M-1 via a noncovalent bond KTB TUMORFORSCHUNGSGESELLSCHAFT MBH (DE) 2011-03-08 US disclosed
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof NOXELL CORPORATION 2011-02-17 US disclosed
EP-1272223-B1 THERAPEUTIC AND DIAGNOSTIC LIGAND SYSTEMS COMPRISING TRANSPORT MOLECULE BINDING PROPERTIES AND MEDICAMENTS CONTAINING THE SAME KTB TUMORFORSCHUNGS GMBH (DE) 2006-05-31 EP disclosed
EP-1051655-B1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY ISTA PHARMACEUTICALS INC (US) 2005-09-28 EP disclosed
US-20030185793-A1 Therapeutic and diagnostic ligand systems comprising transport molecule binding properties and medicaments containing the same Vergell Medical S.A. (CH) 2003-10-02 US disclosed
EP-1051655-A4 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY ISTA PHARMACEUTICALS INC (US) 2003-03-19 EP disclosed
EP-1272223-A1 THERAPEUTIC AND DIAGNOSTIC LIGAND SYSTEMS COMPRISING TRANSPORT MOLECULE BINDING PROPERTIES AND MEDICAMENTS CONTAINING THE SAME KTB Tumorforschungsgesellschaft mbH (DE) 2003-01-08 EP disclosed
WO-2001068142-A1 THERAPEUTIC AND DIAGNOSTIC LIGAND SYSTEMS COMPRISING TRANSPORT MOLECULE BINDING PROPERTIES AND MEDICAMENTS CONTAINING THE SAME KTB TUMORFORSCHUNGSGESELLSCHAFT MBH (DE) 2001-09-20 WO disclosed
US-20010016731-A1 Methods and apparatus for accelerated orthokeratology DEVORE DALE (US) 2001-08-23 US disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
US-6161544-A Methods for accelerated orthokeratology KERATOFORM, INC. (US) 2000-12-19 US disclosed
EP-1051655-A1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY Ista Pharmaceuticals, Inc. (US) 2000-11-15 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
WO-1999039238-A1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY KERATOFORM, INC. (US) 1999-08-05 WO disclosed
US-4225492-A Water-soluble disazo dyestuffs, prepared from unsymmetrical heterocyclic diamines CASSELLA AKTIENGESELLSCHAFT (DE) 1980-09-30 US disclosed
US-4144231-A Soluble trisazo dyestuffs containing a 2-phenyl-benzimidazolyl, -benzoxazolyl or -benzthiazolyl middle component CASSELLA AKTIENGESELLSCHAFT (DE) 1979-03-13 US 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 (2 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-20030185793-A1 Therapeutic and diagnostic ligand systems comprising transport molecule binding properties and medicaments containing the same SLCO1B1, SLCO1B3, SLCO1A2 ALKBH5 3594/4885ALDH1A1 1054/4885KDM4E 4710/4885
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof KRT18, LPO, CYB5R3 ALKBH5 413/4885ALDH1A1 326/4885KDM4E 841/4885

“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.