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 SCHEMBL23363665 | 0.95 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL8930798 | 0.95 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL2324 | 0.95 | — | — | |
| Diethanolamine SCHEMBL5307430 | 0.95 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL5843119 | 0.95 | — | — | |
| Diethanolamine SCHEMBL18916924 | 0.91 | — | — | |
| Diethanolamine SCHEMBL19439562 | 0.91 | — | — | |
| Diethanolamine SCHEMBL4338732 | 0.91 | — | — | |
| Diethanolamine SCHEMBL1584965 | 0.91 | — | — | |
| Diethanolamine SCHEMBL9448596 | 0.91 | — | — |
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-105175940-A | Self-adsorption vibration-proof film | RIJIN MACHINERY EQUIPMENT CO LTD | 2015-12-23 | — | — | CN | disclosed |
| CN-102123947-B | Magnesium hydrate composition and manufacturing method thereof, and resin composition and molded article thereof | MARUO CALCIUM | 2014-02-26 | — | — | CN | disclosed |
| CN-101375216-B | External additive for toner and process for producing the same | NIPPON CHEMICAL IND | 2012-12-19 | — | — | CN | disclosed |
| US-8252730-B2 | Wellbore treatment fluid | SCHLUMBERGER TECHNOLOGY CORPORATION (US) | 2012-08-28 | — | — | US | disclosed |
| CN-102123947-A | Magnesium hydrate composition and manufacturing method thereof, and resin composition and molded article thereof | MARUO CALCIUM | 2011-07-13 | — | — | CN | disclosed |
| US-20100152068-A1 | WELLBORE TREATMENT FLUID | SCHLUMBERGER TECHNOLOGY CORPORATION (US) | 2010-06-17 | — | — | US | disclosed |
| US-20090134356-A1 | EXTERNAL ADDITIVE FOR TONER AND METHOD FOR PRODUCING THE SAME | NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) | 2009-05-28 | — | — | US | disclosed |
| CN-101375216-A | External additive for toner and process for producing the same | NIPPON CHEMICAL IND (JP) | 2009-02-25 | — | — | CN | disclosed |
| WO-2008102122-A1 | WELLBORE TREATMENT FLUID | SCHLUMBERGER TECHNOLOGY B.V. (NL) | 2008-08-28 | — | — | WO | disclosed |
| US-7199173-B2 | Agglomerate and resin composition containing the same | MARUO CALCIUM COMPANY LIMITED (JP) | 2007-04-03 | — | — | US | disclosed |
| US-20060052503-A1 | Agglomerate and resin composition containing the same | MARUO CALCIUM COMPANY LIMITED (JP) | 2006-03-09 | — | — | US | disclosed |