SCHEMBL29421649

SCHEMBL29421649

O=S(=O)([O-])c1cc(S(=O)(=O)[O-])c2c(N=Nc3cccc4ccccc34)c(O)ccc2c1.[Na+].[Na+]

nearest known ligand 0.73

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 2/20 0.50
▸ MAPK1 P28482 4/20 0.73
▸ ALDH1A1 P00352 3/20 0.73
▸ APP P05067 1/20 0.71
▸ CYP1A2 P05177 3/20 0.61
▸ HIF1A Q16665 3/20 0.61
▸ CYP2C9 P11712 2/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ TSHR P16473 1/20 0.61
▸ PTPRA P18433 1/20 0.61
▸ PTPRB P23467 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ RAPGEF4 Q8WZA2 1/20 0.61
▸ PTPN1 P18031 3/20 0.53
▸ DUSP5 Q16690 2/20 0.53
▸ DNASE1L3 Q13609 1/20 0.52
▸ TDP1 Q9NUW8 2/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ ALOX12 P18054 1/20 0.50

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
SCHEMBL10621059 1.00 MAPK1 (0.73) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL1638375 1.00 MAPK1 (0.73) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL93701 0.90 APP (0.72) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL93700 0.90 APP (0.72) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL29353967 0.90 APP (0.72) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL29912825 0.88 APP (0.69) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL10621065 0.84 MAPK1 (1.00) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL1098204 0.84 MAPK1 (1.00) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL1098207 0.84 MAPK1 (1.00) MAPK1ALDH1A1APPCYP1A2HIF1A
SCHEMBL10621049 0.83 MAPK1 (0.98) MAPK1ALDH1A1APPCYP1A2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112946140-B Method for detecting water-soluble anion synthetic pigment in food 广州市食品检验所(广州市酒类检测中心) 2023-03-21 — — CN claimed
WO-2022188373-A1 METHOD FOR DETECTING WATER-SOLUBLE ANIONIC SYNTHETIC PIGMENT IN FOOD 广州市食品检验所(广州市酒类检测中心) 2022-09-15 — — WO claimed
EP-4547208-B1 PROCESS FOR REMOVING THE COLOUR FROM PREVIOUSLY DYED KERATINOUS HAIR FIBRES OREAL (FR) 2026-05-27 — — EP disclosed
US-12636246-B2 Process for colouring hair keratin fibers, comprising the application of a composition comprising at least one (poly)carbodiimide compound and a composition comprising at least one associative polymer and a particular compound L'OREAL (FR) 2026-05-26 — — US disclosed
CN-122094656-A Method for dyeing hair keratin fibres, comprising the step of washing the hair keratin fibres with a particular composition and subsequently applying to the hair keratin fibres a particular dyeing composition — 2026-05-26 — — CN disclosed
WO-2026039882-A1 METHODS FOR REDUCING COLOR FADING IN COLOR-TREATED HAIR L'OREAL (FR) 2026-02-26 — — WO disclosed
US-20260043720-A1 STABILIZED TWO-PART HEMATOXYLIN SOLUTION UTILIZING pH ADJUSTMENT VENTANA MED SYST INC (US) 2026-02-12 — — US disclosed
US-20260027027-A1 FRAGRANCED COMPOSITION COMPRISING AT LEAST ONE SULFUR-COMPRISING ANTIOXIDANT COMPOUND, AT LEAST ONE ORGANIC UV SCREENING AGENT AND AT LEAST ONE FRAGRANCING SUBSTANCE OREAL (FR) 2026-01-29 — — US disclosed
US-12533303-B2 Composition for the simultaneous bleaching and dyeing of keratin fibres and process using this composition L'OREAL (FR) 2026-01-27 — — US disclosed
US-20260007583-A1 COMPOSITION FOR LIGHTENING KERATIN FIBRES AND PROCESS FOR LIGHTENING KERATIN FIBRES USING SAID COMPOSITION OREAL (FR) 2026-01-08 — — US disclosed
US-20250381106-A1 COMPOSITION FOR LIGHTENING KERATIN FIBRES AND PROCESS FOR LIGHTENING KERATIN FIBRES USING SAID COMPOSITION OREAL (FR) 2025-12-18 — — US disclosed
US-20220178795-A1 CYTOLOGICAL STAINING COMPOSITIONS AND USES THEREOF TRIPATH IMAGING, INC. 2022-06-09 — — US disclosed
US-11331257-B2 Biophotonic compositions and methods for providing biophotonic treatment KLOX TECHNOLOGIES INC. (CA) 2022-05-17 — — US disclosed
US-11324823-B2 Biophotonic materials and uses thereof KLOX TECHNOLOGIES INC. (CA) 2022-05-10 — — US disclosed
EP-3986366-A1 COMPOSITION COMPRISING AT LEAST ONE ALKOXYSILANE, AT LEAST ONE NON-AMINO SILICONE AND WATER, THE ALKOXYSILANE/NON-AMINO SILICONE MASS RATIO RANGING FROM 95/5 TO 5/95 L'OREAL (FR) 2022-04-27 — — EP disclosed
CN-114340588-A Composition comprising at least one alkoxysilane of formula (I), at least one alkoxysilane of formula (II), at least one non-amino silicone and optionally a pigment and/or direct dye 莱雅公司 2022-04-12 — — CN disclosed
EP-3151861-B1 SILICONE-BASED BIOPHOTONIC COMPOSITIONS AND USES THEREOF KLOX TECH INC (CA) 2022-04-06 — — EP disclosed
US-20220090993-A1 STABILIZED TWO-PART HEMATOXYLIN SOLUTION UTILIZING pH ADJUSTMENT VENTANA MEDICAL SYSTEMS, INC. 2022-03-24 — — US disclosed
US-11274997-B2 Cytological staining compositions and uses thereof TRIPATH IMAGING, INC. (US) 2022-03-15 — — US disclosed
CN-114184593-A Dynamic surface enhanced Raman spectroscopy detection method 厦门大学 2022-03-15 — — CN 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 (6 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-12533303-B2 Composition for the simultaneous bleaching and dyeing of keratin fibres and process using this composition KRT18, CA12, CA7 THRB 2468/4885MAPK1 2416/4885ALDH1A1 1626/4885
US-20260027027-A1 FRAGRANCED COMPOSITION COMPRISING AT LEAST ONE SULFUR-COMPRISING ANTIOXIDANT COMPOUND, AT LEAST ONE ORGANIC UV SCREENING AGENT AND AT LEAST ONE FRAGRANCING SUBSTANCE CBR3, CBR1, ERCC1 THRB 3716/4885MAPK1 2148/4885ALDH1A1 52/4885
US-20250381106-A1 COMPOSITION FOR LIGHTENING KERATIN FIBRES AND PROCESS FOR LIGHTENING KERATIN FIBRES USING SAID COMPOSITION KRT18, VIM, MAP1LC3A THRB 4386/4885MAPK1 1975/4885ALDH1A1 730/4885
US-20260007583-A1 COMPOSITION FOR LIGHTENING KERATIN FIBRES AND PROCESS FOR LIGHTENING KERATIN FIBRES USING SAID COMPOSITION KRT18, F12, VIM THRB 3644/4885MAPK1 1232/4885ALDH1A1 1427/4885
US-20260043720-A1 STABILIZED TWO-PART HEMATOXYLIN SOLUTION UTILIZING pH ADJUSTMENT SMCHD1, KIT, CD68 THRB 3803/4885MAPK1 892/4885ALDH1A1 1823/4885
US-12636246-B2 Process for colouring hair keratin fibers, comprising the application of a composition comprising at least one (poly)carbodiimide compound and a composition comprising at least one associative polymer and a particular compound KRT18, CYC1, CYBA THRB 1477/4885MAPK1 1320/4885ALDH1A1 197/4885

“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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