SCHEMBL1436602

SCHEMBL1436602

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

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
SCHEMBL108903 0.99 CNR2 (0.47) CNR2CNR1TSHR
SCHEMBL18719294 0.91 TSHR (0.50) CNR2CNR1TSHR
SCHEMBL16490256 0.87 THRB (0.45) CNR2CNR1TSHR
SCHEMBL8853777 0.87 THRB (0.46) CNR2CNR1TSHR
SCHEMBL10595694 0.87 CNR2 (0.43) CNR2CNR1TSHR
SCHEMBL10606320 0.86 CNR2 (0.48) CNR2CNR1TSHR
SCHEMBL30487077 0.86 ALDH1A1 (0.44) CNR2CNR1TSHR
SCHEMBL2107754 0.86 ALDH1A1 (0.44) CNR2CNR1TSHR
SCHEMBL18734058 0.82 THRB (0.40) CNR2CNR1TSHR
SCHEMBL18719346 0.81 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 105 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100021396-A1 TINTING MOUSSE HENKEL AG & CO. KGAA (DE) 2010-01-28 US claimed
EP-3229918-B1 COMPOSITION AND PROCEDURE FOR TREATING KERATINIC FIBERS WITH FLASH EVAPORATION HENKEL AG & CO KGAA (DE) 2024-03-13 EP disclosed
US-10342751-B2 Double-chamber pouch for dyeing human hair HENKEL AG & CO. KGAA (DE) 2019-07-09 US disclosed
US-10259946-B1 Sealing agents, methods of making and uses thereof James Hardie Technology Limited (IE) 2019-04-16 US disclosed
US-10179093-B2 Compositions and methods for coloring keratinic fibers HENKEL AG & CO. KGAA (DE) 2019-01-15 US disclosed
US-10111508-B2 Composition and method for treating keratin fibers with flash evaporation HENKEL AG & CO. KGAA (DE) 2018-10-30 US disclosed
US-20180098927-A1 DOUBLE-CHAMBER POUCH FOR DYEING HUMAN HAIR HENKEL AG & CO. KGAA (DE) 2018-04-12 US disclosed
US-20170312188-A1 COMPOSITIONS AND METHODS FOR COLORING KERATINIC FIBERS HENKEL AG & CO. KGAA (DE) 2017-11-02 US disclosed
US-20170273424-A1 COMPOSITION AND METHOD FOR TREATING KERATIN FIBERS WITH FLASH EVAPORATION HENKEL AG & CO. KGAA (DE) 2017-09-28 US disclosed
US-9173829-B2 Compositions for dyeing keratin fibers HENKEL AG & CO. KGAA (DE) 2015-11-03 US disclosed
US-20030115684-A1 Novel diaminopyrazole derivatives and dyes containing said compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2003-06-26 US disclosed
US-6558433-B2 Oxidation hair dye WELLA AG (DE) 2003-05-06 US disclosed
US-20030041392-A1 Process for making 1,4-diamino-2-methoxymethylbenzene and salts thereof and compositions and methods for dyeing keratin fibers containing same Wella GmbH (DE) 2003-03-06 US disclosed
US-6485529-B1 Agent and method for coloring fibers WELLA AKTIENGESELLSCHAFT (DE) 2002-11-26 US disclosed
US-20020170125-A1 Bridged diaminopyrazole compounds and dye compositions containing same HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2002-11-21 US disclosed
US-6461390-B1 Process for making 2-aminomethyl-1, 4-diaminobenzene and its salts and compositions and methods for dyeing keratin fibers using same WELLA AKTIENGESELLSCHAFT (DE) 2002-10-08 US disclosed
US-6361571-B1 USING TAUTOMERIC NONOXIDATIVE DYES AND POLYMETHINE DYES WELLA AKTIENGESELLSCHAFT (DE) 2002-03-26 US disclosed
US-6231622-B1 MIXTURES; BLUE COLOR WELLA AKTIENGESELLSCHAFT (DE) 2001-05-15 US disclosed
US-6171347-B1 REMOVAL OF HAIR COLOR TO BE WORN FOR ONLY A SHORT PERIOD OF TIME UNDER MILD, GENTLE CONDITIONS BY USING A COMBINATION OF A SUITABLE REDUCTONE, SUCH AS ASCORBIC ACID, AND/OR A THIOL AND/OR A SULFITE WELLA AKTIENGESELLSCHAFT (DE) 2001-01-09 US disclosed
US-6106579-A MIXTURE OF OXOCARBOXYLIC ACID AND REDUCING AGENT WELLA AKTIENGESELLSCHAFT (DE) 2000-08-22 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 (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-20100021396-A1 TINTING MOUSSE KRT18, MSN, MFAP1 CNR2 3524/4885CNR1 3592/4885TSHR 2779/4885
US-20030115684-A1 Novel diaminopyrazole derivatives and dyes containing said compounds AOC1, DPYD, PPOX CNR2 3853/4885CNR1 4149/4885TSHR 4643/4885
US-20030041392-A1 Process for making 1,4-diamino-2-methoxymethylbenzene and salts thereof and compositions and methods for dyeing keratin fibers containing same KRT18, SCNN1B, DDAH1 CNR2 3430/4885CNR1 3648/4885TSHR 4501/4885
US-20020170125-A1 Bridged diaminopyrazole compounds and dye compositions containing same ALK, DDC, CBR1 CNR2 343/4885CNR1 168/4885TSHR 3885/4885

“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.