⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1961289 | 0.89 | TSHR (0.43) | — | |
| Beta-Alanine SCHEMBL3203420 | 0.87 | HTT (0.34) | — | |
| SCHEMBL18579869 | 0.83 | TSHR (0.38) | — | |
| SCHEMBL11487166 | 0.81 | — | — | |
| SCHEMBL253528 | 0.79 | — | — | |
| SCHEMBL1806852 | 0.77 | MAOA (0.37) | — | |
| SCHEMBL1796671 | 0.76 | — | — | |
| SCHEMBL6401629 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL170069 | 0.76 | BBOX1 (0.46) | — | |
| Urea SCHEMBL27483216 | 0.75 | ALDH1A1 (0.44) | — |
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 104 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2337554-B1 | AGENT FOR FIBRES CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER AND AT LEAST ONE SPECIFIC, ADDITIONAL FILM-FORMING ANIONIC AND/OR STABILIZING ANIONIC POLYMER | HENKEL AG & CO KGAA (DE) | 2016-09-07 | — | — | EP | claimed |
| US-20110142781-A1 | AGENT FOR FIBERS CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER AND AT LEAST ONE SPECIFIC, ADDITIONAL FILM-FORMING ANIONIC AND/OR STABILIZING ANIONIC POLYMER | HENKEL AG & CO. KGAA (DE) | 2011-06-16 | — | — | US | claimed |
| WO-2007133582-A1 | SOAP BAR COMPOSITIONS COMPRISING ALPHA SULFONATED ALKYL ESTER OR SULFONATED FATTY ACID AND SYNTHETIC SURFACTANT AND PROCESS FOR PRODUCING THE SAME | STEPAN COMPANY (US) | 2007-11-22 | — | — | WO | claimed |
| US-20070060489-A1 | Cationic surfactant shampoo composition | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) | 2007-03-15 | — | — | US | claimed |
| US-20070004611-A1 | Soap bar compositions comprising alpha sulfonated alkyl ester or sulfonated fatty acid and synthetic surfactant and process for producing the same | OSPINAL CARLOS E | 2007-01-04 | — | — | US | claimed |
| WO-2006062665-A1 | SOAP BARS COMPRISING ALPHA SULFONATED ALKYL ESTER OR SULFONATED FATTY ACID | STEPAN COMPANY (US) | 2006-06-15 | — | — | WO | claimed |
| US-20050153853-A1 | Soap bar compositions comprising alpha sulfonated alkyl ester or sulfonated fatty acid and synthetic surfactant and processes for producing same | STEPAN COMPANY | 2005-07-14 | — | — | US | claimed |
| CN-118346239-A | Pressure driving liquid optimizing method based on molecular simulation | 中海油能源发展股份有限公司 | 2024-07-16 | — | — | CN | disclosed |
| CN-118284337-A | Method for enhancing biocides | 宝洁公司 | 2024-07-02 | — | — | CN | disclosed |
| CN-118265770-A | Laundry detergent formulations | 宝洁公司 | 2024-06-28 | — | — | CN | disclosed |
| WO-2024054115-A1 | ANTIMICROBIAL COMPOSITIONS | AHV International B.V. (NL) | 2024-03-14 | — | — | WO | disclosed |
| US-20240016148-A1 | METHODS FOR POTENTIATING A BIOCIDE | THE PROCTER & GAMBLE COMPANY | 2024-01-18 | — | — | US | disclosed |
| WO-2023225253-A1 | METHODS FOR POTENTIATING A BIOCIDE | THE PROCTER & GAMBLE COMPANY (US) | 2023-11-23 | — | — | WO | disclosed |
| EP-1162254-A1 | Liquid all-purpose cleaners | CLARIANT INTERNATIONAL LTD. (CH) | 2001-12-12 | — | — | EP | disclosed |
| EP-0117530-B1 | PRODUCTION OF N-SUBSTITUTED (METH)ACRYLAMIDES FROM (METH)ACRYLATES AND AMINES OVER A METAL ALKOXIDE CATALYST | TEXACO DEVELOPMENT CORPORATION (US) | 1989-03-29 | — | — | EP | disclosed |
| US-4675441-A | CONDUCTED IN PRESENCE OF ALIQUID CATALYST CONTAINING AN TIN AND/OR ZINC TO NITROGEN BOND | TEXACO INC. (US) | 1987-06-23 | — | — | US | disclosed |
| US-4613673-A | ZINC OR TIN COMPOUNDS WITH METALNITROGEN BOND | TEXACO INC. (US) | 1986-09-23 | — | — | US | disclosed |
| US-4492801-A | ONE STEP PROCESS | TEXACO INC. (US) | 1985-01-08 | — | — | US | disclosed |
| US-4287363-A | BY CATALYTIC REACTION OF A BETA-AMINOPROPIONAMIDE | TEXACO INC. (US) | 1981-09-01 | — | — | US | disclosed |
| US-4133813-A | Cyclic nitrile carbonate-containing compounds | ATLANTIC RICHFIELD COMPANY (US) | 1979-01-09 | — | — | US | disclosed |