Sulfuric Acid

Sulfuric Acid

SCHEMBL147958

C=CC[n+]1ccccc1C(C)=O.O=S(=O)([O-])[O-].[H+]

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ACHE P22303 1/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 1/20 0.30
PKM P14618 1/20 0.30

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
Sulfuric Acid SCHEMBL147959 0.94 KDM4E (0.38) KDM4EACHECYP2D6CYP2C19
SCHEMBL1654139 0.93 KDM4E (0.43) KDM4ECYP2D6CYP2C19
SCHEMBL148209 0.91 KDM4E (0.44) KDM4ECYP2D6CYP2C19
SCHEMBL148488 0.91 KDM4E (0.36) KDM4EACHECYP2D6CYP2C19PKM
Acetic Acid SCHEMBL148715 0.90 KDM4E (0.41) KDM4ECYP2D6CYP2C19
Hydrochloric Acid SCHEMBL151393 0.90 KDM4E (0.46) KDM4EACHECYP2D6CYP2C19
Bromide SCHEMBL147695 0.90 KDM4E (0.43) KDM4EACHECYP2D6CYP2C19PKM
Benzene SCHEMBL1818234 0.90 KDM4E (0.43) KDM4ECYP2D6CYP2C19
SCHEMBL141770 0.87 C5AR1 (0.38) KDM4ECYP2D6MMP1MMP9MMP13
SCHEMBL21837233 0.82 C5AR1 (0.34) KDM4ECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2934472-B1 GENTLE OXIDATIVE HAIR TREATMENT WITH SILICONE PRE-TREATMENT AND BLEACHING FORCE INTENSIFIER HENKEL AG & CO KGAA (DE) 2017-09-13 EP claimed
EP-2651377-B1 BRIGHTENING AGENT COMPRISING ACYLPYRIDINIUM COMPOUNDS AND DEFINED SURFACTANT COMBINATION HENKEL AG & CO KGAA (DE) 2017-04-12 EP claimed
EP-2552394-B1 DYE WITH LIPOPHILIC ACYLPYRIDINIUM COMPLEX HENKEL AG & CO KGAA (DE) 2016-11-02 EP claimed
EP-2552393-B1 LIGHTENER WITH LIPOPHILIC ACYLPYRIDINIUM COMPLEX HENKEL AG & CO KGAA (DE) 2015-03-04 EP claimed
US-20140170100-A1 OXIDATIVE HAIR TREATMENT WITH SILICONE AND BLEACH HENKEL AG & CO. KGAA (DE) 2014-06-19 US claimed
US-8740995-B1 Oxidative hair treatment with silicone and bleach HENKEL AG & CO. KGAA (DE) 2014-06-03 US claimed
US-8668745-B2 Brightening agent comprising acylpyridinium compounds and defined alkalizing agents HENKEL AG & CO. KGAA (DE) 2014-03-11 US claimed
EP-2315576-B1 CATIONIC ACETYLPYRIDINIUM DERIVATIVES FOR USE AS BLEACH ACTIVATORS HENKEL AG & CO KGAA (DE) 2013-12-25 EP claimed
US-8597371-B2 Lightening agent comprising acyl pyridinium compounds and cationic polysaccharides HENKEL AG & CO. KGAA (DE) 2013-12-03 US claimed
US-20130280194-A1 LIGHTENING AGENT COMPRISING ACYL PYRIDINIUM COMPOUNDS AND CATIONIC POLYSACCHARIDES HENKEL AG & CO. KGAA (DE) 2013-10-24 US claimed
US-8277516-B2 Lightening agent having cationic acylpyridinium derivatives and certain ammonium compounds HENKEL AG & CO. KGAA (DE) 2012-10-02 US claimed
US-8277517-B2 Lightening agent having cationic acylpyridinium derivatives and certain amino acids HENKEL AG & CO. KGAA (DE) 2012-10-02 US claimed
US-8273332-B2 Hair care product containing acetylpyridinium salts HENKEL AG & CO. KGAA (DE) 2012-09-25 US claimed
US-8246938-B2 Hair care agent containing acetylpyridinium salts HENKEL AG & CO. KGAA (DE) 2012-08-21 US claimed
US-20120192891-A1 LIGHTENING AGENT HAVING CATIONIC ACYLPYRIDINIUM DERIVATIVES AND CERTAIN AMINO ACIDS HENKEL AG & CO. KGAA (DE) 2012-08-02 US claimed
US-20120192890-A1 LIGHTENING AGENT HAVING CATIONIC ACYLPYRIDINIUM DERIVATIVES AND CERTAIN AMMONIUM COMPOUNDS HENKEL AG & CO. KGAA (DE) 2012-08-02 US claimed
US-20120121528-A1 Hair Care Agent Containing Acetylpyridinium Salts HENKEL AG & CO. KGAA (DE) 2012-05-17 US claimed
US-20120058071-A1 HAIR CARE PRODUCT CONTAINING ACETYLPYRIDINIUM SALTS GROSS WIBKE (DE) 2012-03-08 US claimed
US-8021438-B2 Cationic acylpyridinium derivatives for use as bleach activators HENKEL AG & CO. KGAA (DE) 2011-09-20 US claimed
US-20110146006-A1 CATIONIC ACYLPYRIDINIUM DERIVATIVES FOR USE AS BLEACH ACTIVATORS HENKEL AG & CO. KGAA (DE) 2011-06-23 US 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 (7 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-20130280194-A1 LIGHTENING AGENT COMPRISING ACYL PYRIDINIUM COMPOUNDS AND CATIONIC POLYSACCHARIDES KRT18, LPO, ACOX1 KDM4E 1408/4885ACHE 1472/4885CYP2D6 1339/4885
US-20140170100-A1 OXIDATIVE HAIR TREATMENT WITH SILICONE AND BLEACH KRT18, ALDH7A1, NDUFAB1 KDM4E 255/4885ACHE 2501/4885CYP2D6 1015/4885
US-20120192890-A1 LIGHTENING AGENT HAVING CATIONIC ACYLPYRIDINIUM DERIVATIVES AND CERTAIN AMMONIUM COMPOUNDS KRT18, AAAS, KATNAL2 KDM4E 959/4885ACHE 1902/4885CYP2D6 2612/4885
US-20120058071-A1 HAIR CARE PRODUCT CONTAINING ACETYLPYRIDINIUM SALTS KAT7, EP300, CUTA KDM4E 2247/4885ACHE 739/4885CYP2D6 4267/4885
US-20120121528-A1 Hair Care Agent Containing Acetylpyridinium Salts KAT7, EP300, HDAC7 KDM4E 2816/4885ACHE 811/4885CYP2D6 4444/4885
US-20110146006-A1 CATIONIC ACYLPYRIDINIUM DERIVATIVES FOR USE AS BLEACH ACTIVATORS KRT18, AADAC, KAT7 KDM4E 1245/4885ACHE 487/4885CYP2D6 4608/4885
US-20120192891-A1 LIGHTENING AGENT HAVING CATIONIC ACYLPYRIDINIUM DERIVATIVES AND CERTAIN AMINO ACIDS ALAD, AADAT, ALDH7A1 KDM4E 1317/4885ACHE 3340/4885CYP2D6 2480/4885

“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.