SCHEMBL19583178

SCHEMBL19583178

CC(NC(C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.32

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 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32

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
Potassium Ion SCHEMBL19583160 0.94
SCHEMBL28911777 0.88 TDP1 (0.37)
SCHEMBL7185025 0.84
SCHEMBL5362663 0.79
SCHEMBL6536404 0.77 MEN1 (0.35) MEN1ALDH1A1TSHRKMT2A
SCHEMBL3368673 0.73
SCHEMBL5022370 0.72 ALDH1A1 (0.40) MEN1ALDH1A1TSHRKMT2A
SCHEMBL833093 0.72
Water SCHEMBL28816709 0.71
Water SCHEMBL19915258 0.69

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3229769-B1 BETTER DECOLORATION OF KERATINIC FIBERS HENKEL AG & CO KGAA (DE) 2019-10-23 EP claimed
US-10179099-B2 Decolorization of dyed keratin fibers HENKEL AG & CO. KGAA (DE) 2019-01-15 US claimed
US-20170326055-A1 DECOLORIZATION OF DYED KERATIN FIBERS HENKEL AG & CO. KGAA (DE) 2017-11-16 US claimed
US-11077040-B2 Emulsions for enhanced reductive decoloration of keratin fibers HENKEL AG & CO. KGAA (DE) 2021-08-03 US disclosed
US-10179099-B2 Decolorization of dyed keratin fibers HENKEL AG & CO. KGAA (DE) 2019-01-15 US disclosed
US-20180147128-A1 EMULSIONS FOR ENHANCED REDUCTIVE DECOLORATION OF KERATIN FIBERS HENKEL AG & CO. KGAA (DE) 2018-05-31 US disclosed
US-20170326055-A1 DECOLORIZATION OF DYED KERATIN FIBERS HENKEL AG & CO. KGAA (DE) 2017-11-16 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-10179099-B2 Decolorization of dyed keratin fibers KRT18, DDR1, DDR2 MEN1 3958/4885ALDH1A1 1054/4885TSHR 1194/4885
US-20170326055-A1 DECOLORIZATION OF DYED KERATIN FIBERS KRT18, DDR1, DDR2 MEN1 3958/4885ALDH1A1 1054/4885TSHR 1194/4885
US-20180147128-A1 EMULSIONS FOR ENHANCED REDUCTIVE DECOLORATION OF KERATIN FIBERS KRT18, PRKDC, CUTA MEN1 4123/4885ALDH1A1 41/4885TSHR 4286/4885
US-11077040-B2 Emulsions for enhanced reductive decoloration of keratin fibers KRT18, PRKDC, CUTA MEN1 4123/4885ALDH1A1 41/4885TSHR 4286/4885

“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.