Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethanolamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Diethanolamine SCHEMBL28826340 | 1.00 | SMN1; SMN2 (0.33) | — | |
| Diethanolamine SCHEMBL11849912 | 1.00 | SMN1; SMN2 (0.33) | — | |
| Diethanolamine SCHEMBL2324 | 0.91 | — | — | |
| Diethanolamine SCHEMBL8930798 | 0.91 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL5307430 | 0.91 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL23363665 | 0.91 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL5843119 | 0.91 | — | — | |
| Diethanolamine SCHEMBL8150030 | 0.88 | — | — | |
| Diethanolamine SCHEMBL3344449 | 0.87 | — | — | |
| Diethanolamine SCHEMBL18916924 | 0.87 | — | — |
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-115441051-A | Electrolyte and preparation method and application thereof | 湖北亿纬动力有限公司 | 2022-12-06 | — | — | CN | disclosed |
| EP-2766406-B1 | HYBRID POLYESTER-POLYETHER POLYOLS FOR IMPROVED DEMOLD EXPANSION IN POLYURETHANE RIGID FOAMS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2020-11-25 | — | — | EP | disclosed |
| EP-3388404-A1 | MORTAR COMPOSITION AND METHOD FOR MANUFACTURING SAME, CONCRETE STRUCTURE, AND CONCRETE FRAMEWORK FOUNDATION ADJUSTING METHOD | Showa Denko K.K. (JP) | 2018-10-17 | — | — | EP | disclosed |
| CN-108367985-A | Cement composition and its manufacturing method, the substrate method of adjustment of concrete body and concrete frame | 昭和电工株式会社 | 2018-08-03 | — | — | CN | disclosed |
| EP-2622001-B1 | HIGH FUNCTIONALITY AROMATIC POLYESTERS, POLYOL BLENDS COMPRISING THE SAME AND RESULTANT PRODUCTS THEREFROM | DOW GLOBAL TECHNOLOGIES LLC (US) | 2016-04-20 | — | — | EP | disclosed |
| EP-2766406-A2 | HYBRID POLYESTER-POLYETHER POLYOLS FOR IMPROVED DEMOLD EXPANSION IN POLYURETHANE RIGID FOAMS | Dow Global Technologies LLC (US) | 2014-08-20 | — | — | EP | disclosed |
| US-20140213677-A1 | HYBRID POLYESTER-POLYETHER POLYOLS FOR IMPROVED DEMOLD EXPANSION IN POLYURETHANE RIGID FOAMS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2014-07-31 | — | — | US | disclosed |
| EP-2622001-A1 | HIGH FUNCTIONALITY AROMATIC POLYESTERS, POLYOL BLENDS COMPRISING THE SAME AND RESULTANT PRODUCTS THEREFROM | Dow Global Technologies LLC (US) | 2013-08-07 | — | — | EP | disclosed |
| US-20130184366-A1 | HIGH FUNCTIONALITY AROMATIC POLYESTERS, POLYOL BLENDS COMPRISING THE SAME AND RESULTANT PRODUCTS THEREFROM | DOW GLOBAL TECHNOLOGIES LLC (US) | 2013-07-18 | — | — | US | disclosed |
| WO-2013053555-A2 | HYBRID POLYESTER-POLYETHER POLYOLS FOR IMPROVED DEMOLD EXPANSION IN POLYURETHANE RIGID FOAMS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2013-04-18 | — | — | WO | disclosed |
| WO-2012041709-A1 | HIGH FUNCTIONALITY AROMATIC POLYESTERS, POLYOL BLENDS COMPRISING THE SAME AND RESULTANT PRODUCTS THEREFROM | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-04-05 | — | — | WO | disclosed |