Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 4/20 | 0.56 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.42 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.53 |
| ▸ | APP | P05067 | 2/20 | 0.53 |
| ▸ | GLB1 | P16278 | 1/20 | 0.53 |
| ▸ | CHAT | P28329 | 1/20 | 0.53 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.53 |
| ▸ | CTRC | Q99895 | 1/20 | 0.53 |
| ▸ | SLC7A11 | Q9UPY5 | 3/20 | 0.51 |
| ▸ | ATIC | P31939 | 3/20 | 0.46 |
| ▸ | SUMO2 | P61956 | 1/20 | 0.46 |
| ▸ | SUMO1 | P63165 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP2 | Q9HC62 | 1/20 | 0.46 |
| ▸ | ALB | P02768 | 1/20 | 0.44 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.44 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2987080 | 0.88 | CYP1A2 (0.71) | THRBCYP1A2ENPP2APPPHLPP2 | |
| SCHEMBL29377176 | 0.87 | CYP1A2 (0.69) | THRBCYP1A2ENPP2APPCTRC | |
| SCHEMBL2940833 | 0.87 | CYP1A2 (0.69) | THRBCYP1A2ENPP2APPPHLPP2 | |
| SCHEMBL29849737 | 0.83 | THRB (0.69) | THRBCYP1A2ENPP2APPGLB1 | |
| SCHEMBL28747720 | 0.81 | HSPD1 (0.51) | THRBCYP1A2ENPP2APPGLB1 | |
| SCHEMBL29394629 | 0.80 | THRB (0.65) | THRBCYP1A2ENPP2APPGLB1 | |
| SCHEMBL31496840 | 0.80 | SENP2 (0.55) | THRBCYP1A2ENPP2APPGLB1 | |
| SCHEMBL29702356 | 0.79 | MEN1 (0.51) | CYP1A2SLC7A11SUMO2SUMO1SENP7 | |
| SCHEMBL590710 | 0.77 | THRB (0.61) | THRBCYP1A2ENPP2APPGLB1 | |
| SCHEMBL31059045 | 0.76 | APP (0.44) | THRBENPP2APPGLB1CHAT |
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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5865856-A | MIXTURE CONTAINING COUPLER AND DEVELOPER | WELLA AKTIENGESELLSCHAFT (DE) | 1999-02-02 | — | — | US | claimed |
| US-5766576-A | NONTOXIC DYE DEVELOPER; WASHFASTNESS, COLORFASTNESS, RED COLOR INTENSITY | WELLA AKTIENGESELLSCHAFT (DE) | 1998-06-16 | — | — | US | claimed |
| US-5645610-A | COUPLER, DEVELOPER | WELLA AKTIENGESELLSCHAFT (DE) | 1997-07-08 | — | — | US | claimed |
| US-5542953-A | COUPLERS WITH IMPROVED WATER SOLUBILITY, SHELF STABILITY; COLORFAST HAIR DYES WITH VARIETY OF SHADES | WELLA AG (DE) | 1996-08-06 | — | — | US | claimed |
| US-5534267-A | Composition for the oxidative dyeing of hair containing 4,5-diaminopyrazole derivatives as well as new 4,5-diaminopyrazole derivatives and process for their synthesis | WELLA AKTIENGESELLSCHAFT (DE) | 1996-07-09 | — | — | US | claimed |
| US-5480459-A | Oxidative hair dye based on a creamlike carrier composition as well as process for the dyeing of hair | WELLA AKTIENGESELLSCHAFT (DE) | 1996-01-02 | — | — | US | claimed |
| US-5468256-A | Solvent, anionic, cationic or nonionic surfactant with monoazo dye | WELLA AKTIENGESELLSCHAFT (DE) | 1995-11-21 | — | — | US | claimed |
| US-5409503-A | High color intensity red shades | WELLA AKTIENGESELLSCHAFT (DE) | 1995-04-25 | — | — | US | claimed |
| US-4473375-A | COUPLER AND DEVELOPER FOR OXIDATION COLOR DYES | WELLA AKTIENGESELLSCHAFT (DE) | 1984-09-25 | — | — | US | claimed |
| EP-1752192-B1 | Oxidizing hair coloring agents containing m-Aminophenol derivatives | PROCTER & GAMBLE (US) | 2010-02-03 | — | — | EP | disclosed |
| US-7641702-B2 | O-Aminophenol derivatives and colorants containing said compounds | WELLA AG (DE) | 2010-01-05 | — | — | US | disclosed |
| US-7491244-B2 | Oxidizing hair coloring agents containing m-aminophenol derivatives | THE PROCTER & GAMBLE COMPANY (US) | 2009-02-17 | — | — | US | disclosed |
| US-20080235882-A1 | Novel O-Aminophenol Derivatives and Colorants Containing Said Compounds | HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) | 2008-10-02 | — | — | US | disclosed |
| EP-1817379-A2 | PYRAZOLE AZOMETHINES AND COLORANTS CONTAINING THESE COMPOUNDS | The Procter and Gamble Company (US) | 2007-08-15 | — | — | EP | disclosed |
| US-5645610-A | COUPLER, DEVELOPER | WELLA AKTIENGESELLSCHAFT (DE) | 1997-07-08 | — | — | US | disclosed |
| US-5637115-A | Oxidation hair dye compositions containing developers, couplers, and AZO dyes | WELLA AKTIENGESELLSCHAT (DE) | 1997-06-10 | — | — | US | disclosed |
| US-5542953-A | COUPLERS WITH IMPROVED WATER SOLUBILITY, SHELF STABILITY; COLORFAST HAIR DYES WITH VARIETY OF SHADES | WELLA AG (DE) | 1996-08-06 | — | — | US | disclosed |
| US-5534267-A | Composition for the oxidative dyeing of hair containing 4,5-diaminopyrazole derivatives as well as new 4,5-diaminopyrazole derivatives and process for their synthesis | WELLA AKTIENGESELLSCHAFT (DE) | 1996-07-09 | — | — | US | disclosed |
| US-5480459-A | Oxidative hair dye based on a creamlike carrier composition as well as process for the dyeing of hair | WELLA AKTIENGESELLSCHAFT (DE) | 1996-01-02 | — | — | US | disclosed |
| US-4473375-A | COUPLER AND DEVELOPER FOR OXIDATION COLOR DYES | WELLA AKTIENGESELLSCHAFT (DE) | 1984-09-25 | — | — | 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 (1 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20080235882-A1 | Novel O-Aminophenol Derivatives and Colorants Containing Said Compounds | CBR3, KRT18, F12 | THRB 2745/4885CA12 368/4885CA2 983/4885 |
“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.