⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28175356 | 0.96 | — | — | |
| Ammonia Solution, Strong SCHEMBL1326220 | 0.82 | TSHR (0.30) | — | |
| SCHEMBL4268112 | 0.78 | ALDH1A1 (0.37) | — | |
| SCHEMBL31417773 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL8517699 | 0.78 | TSHR (0.32) | — | |
| Hydrochloric Acid SCHEMBL9241479 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL7192571 | 0.74 | — | — | |
| SCHEMBL1269286 | 0.74 | — | — | |
| SCHEMBL6364682 | 0.74 | TSHR (0.33) | — | |
| SCHEMBL991394 | 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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116371223-A | Microbial contamination resistant seawater desalination membrane | 湖南澳维膜科技有限公司 | 2023-07-04 | — | — | CN | claimed |
| CN-115975164-A | Polycarbonate and preparation method and application thereof | 万华化学集团股份有限公司 | 2023-04-18 | — | — | CN | claimed |
| CN-107189008-A | A kind of lower molecular weight amphiprotic polyacrylamide and preparation method thereof | 江苏富淼科技股份有限公司 | 2017-09-22 | — | — | CN | claimed |
| US-4831189-A | PEROXIDATION USING TUNGSTEN CATALYST AND PHASE TRANSFER AGENT | NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) | 1989-05-16 | — | — | US | claimed |
| US-4761507-A | Isomerization of linalyl halides with quaternary salts | UNION CAMP CORPORATION (US) | 1988-08-02 | — | — | US | claimed |
| EP-0132543-B1 | ISOMERIZATION OF ALLYLIC HALIDES WITH QUATERNARY SALTS | Union Camp Corporation (US) | 1986-10-08 | — | — | EP | claimed |
| EP-0132543-A1 | Isomerization of allylic halides with quaternary salts | Union Camp Corporation (US) | 1985-02-13 | — | — | EP | claimed |
| CN-117337279-A | Method for obtaining biogenic diallyl dialkyl ammonium halides | 爱森集团 | 2024-01-02 | — | — | CN | disclosed |
| CN-113518613-B | Bio-based pearlescent wax | 巴斯夫欧洲公司 | 2023-12-01 | — | — | CN | disclosed |
| CN-117120406-A | Dialkyl pentene ether and dialkyl pentadiene ether derivatives as fragrances | 巴斯夫欧洲公司 | 2023-11-24 | — | — | CN | disclosed |
| CN-117120407-A | Aryl/alkenyl pentenal derivatives as fragrance chemicals | 巴斯夫欧洲公司 | 2023-11-24 | — | — | CN | disclosed |
| CN-117062899-A | 2- (2- (3-methylbut-2-en-1-yl) phenyl) propanal and mixtures thereof as fragrance ingredients | 巴斯夫欧洲公司 | 2023-11-14 | — | — | CN | disclosed |
| WO-2023208489-A1 | OXIDATIVE HAIR-LIGHTENING AGENTS HAVING IMPROVED APPLICATION PROPERTIES FOR BLEACHING HAIR ROOTS | HENKEL AG & CO. KGAA (DE) | 2023-11-02 | — | — | WO | disclosed |
| EP-0376485-B1 | QUATERNARY POLYAMINE AS SULFITE OXIDATION INHIBITOR | THE DOW CHEMICAL COMPANY (US) | 1993-08-04 | — | — | EP | disclosed |
| EP-0169603-B1 | PREPARATION OF N-SUBSTITUTED-3-CYANO AZETIDINE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-02-22 | — | — | EP | disclosed |
| EP-0132543-B1 | ISOMERIZATION OF ALLYLIC HALIDES WITH QUATERNARY SALTS | Union Camp Corporation (US) | 1986-10-08 | — | — | EP | disclosed |
| EP-0169603-A1 | Preparation of N-substituted-3-cyano azetidine derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-01-29 | — | — | EP | disclosed |
| EP-0075514-A1 | Cationic polymers and surfactants as silica polymerization retardants and dispersants | CALGON CORPORATION (US) | 1983-03-30 | — | — | EP | disclosed |
| US-4324775-A | SCRUBBING WITH ALKALI METAL SALT OF DIVALENT ANION, ION EXCHANGING WITH AMINE SALT | TUNG SHAO E | 1982-04-13 | — | — | US | disclosed |
| US-4211761-A | Process for removal of sulfur dioxide from gaseous mixtures | TUNG SHAO E | 1980-07-08 | — | — | US | disclosed |