SCHEMBL1024108

SCHEMBL1024108

Cc1cccc(S(=O)(=O)[O-])c1C.Cc1cccc(S(=O)(=O)[O-])c1C.[Ca+2]

nearest known ligand 0.44

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
PTGS1 known ✓ P23219 1/20 0.35
KMT2A Q03164 3/20 0.44
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
TSHR P16473 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
P2RY2 P41231 1/20 0.40
P2RY4 P51582 1/20 0.40
TRPA1 O75762 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 1/20 0.36
ESR1 P03372 1/20 0.36
GAA P10253 1/20 0.36
ESR2 Q92731 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 2/20 0.35

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
Lithium Ion SCHEMBL1176367 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
Zinc Ion SCHEMBL1588842 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL10651982 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL30774597 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL35915 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL10652003 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL5136382 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL4853327 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
Potassium Ion SCHEMBL338797 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2
SCHEMBL982526 0.96 KMT2A (0.44) KMT2AKEAP1NFE2L2TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630786-B2 Solid composition comprising benzyloxide, sulfonate carrier, and non-hygroscopic acid, and its use in cleaning compositions ECOLAB USA INC. (US) 2026-05-19 US claimed
WO-2026102290-A1 ENZYMATIC CAUSTIC FREE DETERGENT COMPOSITIONS FOR CLEANING DAIRY PROCESSING SYSTEMS ECOLAB USA INC. (US) 2026-05-15 WO claimed
US-20260125615-A1 ENZYMATIC CAUSTIC FREE DETERGENT COMPOSITIONS FOR CLEANING DAIRY PROCESSING SYSTEMS ECOLAB USA INC (US) 2026-05-07 US claimed
EP-4689040-A1 SOLID BENZYLOXIDE COMPOSITIONS, METHODS OF MAKING, AND USE IN CLEANING Ecolab USA Inc. (US) 2026-02-11 EP claimed
EP-4569060-A1 A MULTIPURPOSE LIQUID RINSE AID Ecolab USA, Inc. (US) 2025-06-18 EP claimed
US-20250092335-A1 SOLIDIFICATION PROCESS USING LOW LEVELS OF COUPLER/HYDROTROPE ECOLAB USA INC. 2025-03-20 US claimed
US-12252666-B2 Rinse aid formulation for cleaning automotive parts ECOLAB USA INC. (US) 2025-03-18 US claimed
WO-2025024302-A1 EDIBLE COATING COMPOSITIONS APEEL TECHNOLOGY, INC. (US) 2025-01-30 WO claimed
US-20250019619-A1 SOLID RINSE AID COMPOSITION COMPRISING POLYACRYLIC ACID ECOLAB USA INC. 2025-01-16 US claimed
US-12134750-B2 Solidification process using low levels of coupler/hydrotrope ECOLAB USA INC. (US) 2024-11-05 US claimed
US-6162783-A Liquid detergents containing proteolytic enzyme and protease inhibitors THE PROCTER & GAMBLE COMPANY (US) 2000-12-19 US claimed
WO-2000043475-A2 DISHWASHING COMPOSITIONS COMPRISING MODIFIED ALKYLBENZENE SULFONATES THE PROCTER & GAMBLE COMPANY (US) 2000-07-27 WO claimed
CN-1238001-A Liquid detergents containing proteolytic enzyme, peptide aldehyde and calcium ions PROCTER & GAMBLE (US) 1999-12-08 CN claimed
EP-0929639-A1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND CALCIUM IONS THE PROCTER & GAMBLE COMPANY (US) 1999-07-21 EP claimed
EP-0715651-B1 CONCENTRATED LIQUID OR GEL DISHWASHING DETERGENT COMPOSITION CONTAINING CALCIUM XYLENE SULFONATE PROCTER & GAMBLE (US) 1998-10-21 EP claimed
WO-1998013459-A1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND CALCIUM IONS THE PROCTER & GAMBLE COMPANY (US) 1998-04-02 WO claimed
CN-1133061-A Concentrated liquid or gel dishwashing detergent composition containing calcium xylene sulfonate PROCTER & GAMBLE (US) 1996-10-09 CN claimed
EP-0715651-A1 CONCENTRATED LIQUID OR GEL DISHWASHING DETERGENT COMPOSITION CONTAINING CALCIUM XYLENE SULFONATE THE PROCTER & GAMBLE COMPANY (US) 1996-06-12 EP claimed
US-5415814-A Concentrated liquid or gel light duty dishwashing detergent composition containing calcium xylene sulfonate THE PROCTER & GAMBLE COMPANY (US) 1995-05-16 US claimed
WO-1995006108-A1 CONCENTRATED LIQUID OR GEL DISHWASHING DETERGENT COMPOSITION CONTAINING CALCIUM XYLENE SULFONATE THE PROCTER & GAMBLE COMPANY (US) 1995-03-02 WO 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 (2 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-20260125615-A1 ENZYMATIC CAUSTIC FREE DETERGENT COMPOSITIONS FOR CLEANING DAIRY PROCESSING SYSTEMS CEL, PNLIP, CTRC PTGS1 3968/4885KMT2A 4424/4885KEAP1 3645/4885
US-12630786-B2 Solid composition comprising benzyloxide, sulfonate carrier, and non-hygroscopic acid, and its use in cleaning compositions HAO2, SMCHD1, ABCB11 PTGS1 3064/4885KMT2A 1044/4885KEAP1 781/4885

“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.