SCHEMBL146863

SCHEMBL146863

CC(=O)[n+]1ccccc1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL347378 1.00
Water SCHEMBL28256104 0.97 KMT2A (0.33)
Iodide SCHEMBL7215913 0.97 KMT2A (0.33)
Hydrochloric Acid SCHEMBL367909 0.97 KMT2A (0.33)
Hydrochloric Acid SCHEMBL4594095 0.97 KMT2A (0.33)
Ammonia Solution, Strong SCHEMBL7067135 0.97 KMT2A (0.33)
Bromide SCHEMBL1697366 0.97 KMT2A (0.38)
Hydrochloric Acid SCHEMBL5533668 0.94 KMT2A (0.32)
Hydrochloric Acid SCHEMBL5533672 0.94 KMT2A (0.32)
Hydrochloric Acid SCHEMBL27469296 0.94 KMT2A (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119880877-A Online detection method and system for acetylation reaction conversion rate of aromatic hydroxy formic acid compound 浙江大学 2025-04-25 CN claimed
EP-2429483-B1 HAIR CARE PRODUCT CONTAINING ACETYLPYRIDINIUM SALTS HENKEL AG & CO KGAA (DE) 2015-11-25 EP claimed
US-20150174145-A1 Pharmaceutical compounds with the structure of ionic salts with antibiotic and anticancer action CORREIA PEDRO BRITO (PT) 2015-06-25 US claimed
EP-2429484-B1 HAIR CARE AGENT CONTAINING ACETYLPYRIDINIUM SALTS HENKEL AG & CO KGAA (DE) 2015-03-25 EP claimed
EP-2440174-B1 AFTERTREATMENT FOR COLOR FIXATION HENKEL AG & CO KGAA (DE) 2014-12-17 EP claimed
US-8349023-B2 After treatment for color fixation HENKEL AG & CO. KGAA (DE) 2013-01-08 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-20120121528-A1 Hair Care Agent Containing Acetylpyridinium Salts HENKEL AG & CO. KGAA (DE) 2012-05-17 US claimed
US-20120080046-A1 After Treatment for Color Fixation HENKEL AG & CO. KGAA (DE) 2012-04-05 US claimed
WO-2010130510-A2 HAIR SHAPING PRODUCT CONTAINING ACETYLPYRIDINIUM SALTS HENKEL AG & CO. KGAA (DE) 2010-11-18 WO claimed
EP-2184064-A2 LIGANDS OF 5-HT6 RECEPTORS, A PHARMACEUTICAL COMPOSITION, METHOD FOR THE PRODUCTION AND USE THEREOF Alla Chem, LLC. (US) 2010-05-12 EP claimed
US-7053055-B2 Compounds of unstable DP IV-inhibitors PROSIDION LTD. (GB) 2006-05-30 US claimed
US-6846406-B2 Process and catalysts for eliminating sulphur compounds from the gasoline fraction CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2005-01-25 US claimed
US-20030183555-A1 Process for the elimination of sulphur compounds from the gasoline fraction, characterized in that it comprises carrying out an oxidation reaction of said sulphur compounds using at least one organic- inorganic composite as a catalyst UNIVERSIDAD POLITECNICA DE VALENCIA (ES) 2003-10-02 US claimed
EP-1342772-A1 PROCESS AND CATALYSTS FOR ELIMINATING SULFUR COMPOUNDS FROM THE GASOLINE FRACTION CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2003-09-10 EP claimed
CN-1076108-A Blood bag and preparation method thereof RUBINSTEIN ARYE (US) 1993-09-15 CN claimed
EP-0226319-B1 ELECTROCHEMICAL DIMERIZATIONS OF PYRIDINIUM SALTS REILLY INDUSTRIES, INC. (US) 1991-08-07 EP claimed
EP-0226319-A1 Electrochemical dimerizations of pyridinium salts REILLY INDUSTRIES, INC. (US) 1987-06-24 EP claimed
US-4670111-A Electrochemical dimerizations of pyridinium salts REILLY TAR & CHEMICAL CORP. (US) 1987-06-02 US claimed