SCHEMBL185277

SCHEMBL185277

O=S(=O)([O-])c1cc(S(=O)(=O)[O-])c2c(N=Nc3ccc(N=Nc4ccccc4)cc3)c(O)ccc2c1.[Na+].[Na+]

nearest known ligand 0.98

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)

geneUniProtsupporting neighboursconfidence
▸ THRB known ✓ P10828 3/20 0.59
▸ APP P05067 1/20 0.98
▸ MAPK1 P28482 3/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ ALOX12 P18054 1/20 0.58
▸ RECQL P46063 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ DUSP5 Q16690 1/20 0.49
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ SUMO2 P61956 1/20 0.47
▸ SUMO1 P63165 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP2 Q9HC62 1/20 0.47

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
Orange G SCHEMBL81967 0.99 APP (1.00) APPTHRBMAPK1ALDH1A1TDP1
Orange G SCHEMBL29369740 0.99 APP (1.00) APPTHRBMAPK1ALDH1A1TDP1
Orange G SCHEMBL3873344 0.99 APP (1.00) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL1098585 0.83 APP (0.69) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL461768 0.83 APP (0.69) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL110351 0.83 APP (0.69) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL29353967 0.83 APP (0.72) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL93700 0.83 APP (0.72) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL93701 0.83 APP (0.72) APPTHRBMAPK1ALDH1A1TDP1
SCHEMBL7921324 0.82 APP (0.67) APPTHRBMAPK1ALDH1A1TDP1

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 1188 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4701617-A1 METHOD FOR DYEING KERATIN FIBERS, COMPRISING THE USE OF A DYE CONTAINING CHITOSANE AND A DYEING COMPOUND, AND THE USE OF AN AFTERTREATMENT AGENT CONTAINING PROTEIN HYDROLYSATE AND/OR AMINO ACID Henkel AG & Co. KGaA (DE) 2026-03-04 — — EP claimed
EP-4701618-A1 METHOD FOR DYEING KERATIN FIBERS, COMPRISING THE USE OF A DYE CONTAINING CHITOSANE AND A DYEING COMPOUND, AND THE USE OF A SHAMPOO Henkel AG & Co. KGaA (DE) 2026-03-04 — — EP claimed
EP-3723864-B1 THICKENED ONE-COMPONENT HAIR TONER HENKEL AG & CO KGAA (DE) 2026-01-14 — — EP claimed
US-20250340460-A1 METAL OXIDE MODIFIED ZEOLITIC IMIDAZOLATE FRAMEWORK-8 FOR WATER TREATMENT KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2025-11-06 — — US claimed
EP-4398865-B1 MAKEUP KIT COMPRISING AN AQUEOUS MAKEUP COMPOSITION AND A CONTINUOUS OILY-PHASE FIXING COMPOSITION WITH A HYDROPHOBIC FILM-FORMING POLYMER OREAL (FR) 2025-10-29 — — EP claimed
US-12383478-B2 Cosmetic product for dyeing keratin fibers KAO CORPORATION (JP) 2025-08-12 — — US claimed
EP-3873402-B1 METHOD FOR TREATING HAIR, COMPRISING THE APPLICATION OF AN ORGANIC SILICON COMPOUND, AN ALKALISING AGENT AND A FILM-FORMING POLYMER HENKEL AG & CO KGAA (DE) 2025-02-26 — — EP claimed
EP-3873416-B1 METHOD FOR TREATING HAIR, COMPRISING THE APPLICATION OF A FIRST AGENT (A) HAVING A SILANE AND A CHROMOPHORIC COMPOUND, AND A SECOND AGENT (B) HAVING A FILM-FORMING POLYMER HENKEL AG & CO KGAA (DE) 2025-02-26 — — EP claimed
US-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2024-12-26 — — US claimed
CN-119108665-A Electrolyte additive, aqueous electrolyte and zinc-based energy storage device 清华大学深圳国际研究生院 2024-12-10 — — CN claimed
US-11382851-B2 Hair dye composition containing at least one organic silicon compound, a direct dye and a film forming hydrophobic polymer HENKEL AG & CO. KGAA (DE) 2022-07-12 — — US claimed
EP-2883531-B1 Bleaching and coloring composition for hair KAO CORP (JP) 2022-06-15 — — EP claimed
US-11331258-B2 Method for dyeing keratinous material, comprising the use of an organosilicon compound, an oligoalkylsiloxane and a dyeing compound HENKEL AG & CO. KGAA (DE) 2022-05-17 — — US claimed
CN-114487170-A Method for detecting illegally added compounds in food 张缤 2022-05-13 — — CN claimed
EP-3989920-A1 ADDITIVES FOR COLORING AGENTS AND METHODS OF USE THEREOF Living Proof, Inc. (US) 2022-05-04 — — EP claimed
CN-114388077-A Traditional Chinese medicine dyed material database based on micro-focusing Raman technology and application thereof in identification of traditional Chinese medicine dyed materials 成都市食品药品检验研究院 2022-04-22 — — CN claimed
US-11291622-B2 Method for dyeing keratinous material, comprising the use of an organosilicon compound, a dyeing compound and a silicon oil HENKEL AG & CO. KGAA (DE) 2022-04-05 — — US claimed
CN-114222555-A Additives for colorants and methods of use thereof 生活实验公司 2022-03-22 — — CN claimed
CN-114062546-A Method for simultaneously screening 8 illegal coloring agents in muscle-relaxing and blood-circulation-promoting tablets 巩长芹 2022-02-18 — — CN claimed
EP-2930126-B1 Fashionable aerosol dye HENKEL AG & CO KGAA (DE) 2019-10-09 — — EP claimed

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

For each of this compound's patents that has machine-readable text (5 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-11291622-B2 Method for dyeing keratinous material, comprising the use of an organosilicon compound, a dyeing compound and a silicon oil KRT18, MKI67, DSG1 THRB 4573/4885APP 1570/4885MAPK1 2306/4885
US-12383478-B2 Cosmetic product for dyeing keratin fibers KRT18, H1-2, H1-0 THRB 2470/4885APP 3451/4885MAPK1 192/4885
US-11331258-B2 Method for dyeing keratinous material, comprising the use of an organosilicon compound, an oligoalkylsiloxane and a dyeing compound KRT18, MKI67, PCNA THRB 4768/4885APP 1785/4885MAPK1 4042/4885
US-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KRT18, COL14A1, COL1A1 THRB 2991/4885APP 1888/4885MAPK1 1784/4885
US-11382851-B2 Hair dye composition containing at least one organic silicon compound, a direct dye and a film forming hydrophobic polymer KRT18, DSG1, CUTA THRB 2660/4885APP 604/4885MAPK1 2029/4885

“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.

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