SCHEMBL108903

SCHEMBL108903

CCN(Cc1ccc(S(=O)(=O)O)cc1)c1ccc(C(c2ccc(N(CC)Cc3ccc(S(=O)(=O)O)cc3)cc2)c2ccccc2S(=O)(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 19/20 0.47
CNR1 P21554 10/20 0.47
TSHR P16473 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
SCHEMBL1436602 0.99 CNR2 (0.47) CNR2CNR1TSHR
SCHEMBL18719294 0.92 TSHR (0.50) CNR2CNR1TSHR
SCHEMBL16490256 0.88 THRB (0.45) CNR2CNR1TSHR
SCHEMBL8853777 0.88 THRB (0.46) CNR2CNR1TSHR
SCHEMBL10595694 0.88 CNR2 (0.43) CNR2CNR1TSHR
SCHEMBL10606320 0.87 CNR2 (0.48) CNR2CNR1TSHR
SCHEMBL30487077 0.87 ALDH1A1 (0.44) CNR2CNR1TSHR
SCHEMBL2107754 0.87 ALDH1A1 (0.44) CNR2CNR1TSHR
SCHEMBL18734058 0.83 THRB (0.40) CNR2CNR1TSHR
SCHEMBL18719346 0.82 CNR2 (0.46) CNR2CNR1TSHR

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424491-B1 FILM FORMER IN HAIR COLOURS HENKEL AG & CO KGAA (DE) 2017-05-24 EP disclosed
EP-2103299-B1 Oxidizing hair colourant compositions PROCTER & GAMBLE (US) 2013-02-27 EP disclosed
EP-2424491-A2 FILM FORMER IN HAIR DYES Henkel AG & Co. KGaA (DE) 2012-03-07 EP disclosed
EP-2379051-A2 COLORING CONDITIONERS Henkel AG & Co. KGaA (DE) 2011-10-26 EP disclosed
WO-2010124897-A2 FILM FORMER IN HAIR DYES HENKEL AG & CO. KGAA (DE) 2010-11-04 WO disclosed
EP-2200735-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF COLORING AGENTS FOR KERATINIC FIBERS Henkel AG & Co. KGaA (DE) 2010-06-30 EP disclosed
WO-2010015471-A2 COLORING CONDITIONERS HENKEL AG & CO. KGAA (DE) 2010-02-11 WO disclosed
US-7597898-B2 A container is filled with a mixture of a cationic cellulose derivative (Polyquaternium), chitosans, one acid for neutralizing, a solvent, pumping with or without a propellant; film-forming nonionic polymer improves hair fixing properties, nondepositing; hair dyes WELLA AG (DE) 2009-10-06 US disclosed
EP-2103299-A2 Oxidizing hair colourant compositions The Procter and Gamble Company (US) 2009-09-23 EP disclosed
WO-2009077302-A2 TINTING GEL FOAM HENKEL AG & CO. KGAA (DE) 2009-06-25 WO disclosed
US-7018426-B2 Oxidation dye WELLA AG (DE) 2006-03-28 US disclosed
WO-2005094763-A1 HAIR COLORING AGENT CONTAINING INDIGOID VAT DYES WELLA AKTIENGESELLSCHAFT (DE) 2005-10-13 WO disclosed
WO-2005080315-A1 (3,5-DIAMINOPHENYL)(2,4-DIHYDROXYPHENYL)METHANONE AND ITS ACID ADDUCTS, METHOD FOR THE PRODUCTION OF THE LATTER AND USE OF SAID COMPOUNDS FOR COLOURING FIBRES WELLA AKTIENGESELLSCHAFT (DE) 2005-09-01 WO disclosed
US-20040228809-A1 A container is filled with a mixture of a cationic cellulose derivative (Polyquaternium), chitosans, one acid for neutralizing, a solvent, pumping with or without a propellant; film-forming nonionic polymer improves hair fixing properties, nondepositing; hair dyes Wella GmbH (DE) 2004-11-18 US disclosed
US-20040037786-A1 Aerosol foam product for hair treatment WELLA AKTIENGESELLSCHAFT (DE) 2004-02-26 US disclosed
US-20030215479-A1 Process for manufacture of hair or skin cosmetic products using apparatuses with microstructured units WELLA AKTIENGESELLSCHART (DE) 2003-11-20 US disclosed
US-20030159222-A1 Oxidation dye HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2003-08-28 US disclosed
US-20020189031-A1 Use of salts for improving the absorption qualities of anionic direct dyes WELLA AKTIENGESELLSCHAFT (DE) 2002-12-19 US disclosed
US-6379400-B1 DYEING FIBERS, SOLVENT OF WATER OR ALCOHOL AND NITROANILINE DYE WELLA AKTIENGESELLSCHAFT (DE) 2002-04-30 US disclosed
US-20020000012-A1 Compositions and methods for dyeing keratin fibers, especially hair WELLA AKTIENGESELLSCHAFT (DE) 2002-01-03 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-20030159222-A1 Oxidation dye KRT18, NOX4, VIM CNR2 4849/4885CNR1 4878/4885TSHR 4742/4885
US-20020000012-A1 Compositions and methods for dyeing keratin fibers, especially hair KRT18, DSG1, KRTCAP2 CNR2 4010/4885CNR1 4028/4885TSHR 4119/4885

“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.