⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10308640 | 0.87 | ALDH1A1 (0.46) | — | |
| SCHEMBL134919 | 0.87 | TSHR (0.39) | — | |
| 2-Methoxyethanol SCHEMBL9655954 | 0.86 | ALDH1A1 (0.39) | — | |
| Propanol SCHEMBL11699640 | 0.84 | ALDH1A1 (0.33) | — | |
| SCHEMBL27972128 | 0.84 | CYP4F2 (0.36) | — | |
| SCHEMBL29153173 | 0.84 | ALDH1A1 (0.54) | — | |
| SCHEMBL4967622 | 0.84 | TSHR (0.37) | — | |
| SCHEMBL18686720 | 0.84 | — | — | |
| Ethylene Glycol SCHEMBL28396571 | 0.84 | TSHR (0.37) | — | |
| Alcohol SCHEMBL27677214 | 0.84 | ALDH1A1 (0.38) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116615306-A | Polishing composition for fluorophosphate glass and polishing method using polishing composition for fluorophosphate glass | 山口精研工业株式会社 | 2023-08-18 | — | — | CN | disclosed |
| CN-104024366-A | Additive for polishing agent, and polishing method | ASAHI GLASS CO LTD | 2014-09-03 | — | — | CN | disclosed |
| CN-103459089-A | Polishing agent and polishing method | ASAHI GLASS CO LTD | 2013-12-18 | — | — | CN | disclosed |
| CN-101688145-B | Functional fluid | CHIYODA CHEMICAL CO LTD | 2013-03-27 | — | — | CN | disclosed |
| US-20120178714-A1 | Phosphorus-containing Compounds & Uses Thereof | ARIAD PHARMACEUTICALS, INC. (US) | 2012-07-12 | — | — | US | disclosed |
| CN-101688145-A | Functional fluid | CHIYODA CHEMICAL CO LTD | 2010-03-31 | — | — | CN | disclosed |
| CN-100422300-C | Fabric care compositions containing cationic polysiloxanes and methods of use thereof | PROCTER & GAMBLE (US) | 2008-10-01 | — | — | CN | disclosed |
| CN-1471570-A | Fabric care compositions containing cationic polysiloxanes and methods of use thereof | — | 2004-01-28 | — | — | CN | disclosed |
| CN-1094896-C | Method and apparatus for delivering variable flow of hydrogen peroxide | ATOCHEM ELF SA (FR) | 2002-11-27 | — | — | CN | disclosed |
| CN-1218442-A | Method and apparatus for delivering variable flow of hydrogen peroxide | ATOCHEM ELF SA (FR) | 1999-06-02 | — | — | CN | disclosed |
| CN-1176629-A | Apparatus for feeding hydrogen peroxide to a processing unit in an industrial facility | CHEMOXAL SA (FR) | 1998-03-18 | — | — | CN | disclosed |