Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethylamine. 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 | |
|---|---|---|---|---|
| Diethylamine SCHEMBL19615007 | 1.00 | TP53 (0.57) | — | |
| Diethylamine SCHEMBL30789030 | 1.00 | TP53 (0.57) | — | |
| Diethylamine SCHEMBL27873848 | 0.97 | TP53 (0.53) | — | |
| Diethylamine SCHEMBL27866605 | 0.97 | TP53 (0.53) | — | |
| Diethylamine SCHEMBL27513484 | 0.97 | TP53 (0.53) | — | |
| Diethylamine SCHEMBL27866606 | 0.84 | TP53 (0.47) | — | |
| Phosphonic Acid SCHEMBL11580983 | 0.82 | TSHR (0.46) | — | |
| Diethylamine SCHEMBL29452965 | 0.81 | — | — | |
| Diethylamine SCHEMBL27836291 | 0.81 | — | — | |
| Diethylamine SCHEMBL27919421 | 0.80 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200317976-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2020-10-08 | — | — | US | claimed |
| EP-3458539-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | Monash University (AU) | 2019-03-27 | — | — | EP | claimed |
| WO-2017197438-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2017-11-23 | — | — | WO | claimed |
| CN-102776053-A | Composite extreme pressure anti-wear agent and total-synthesis anti-wear hydraulic oil containing same | SHANDONG YUANGEN PETROLEUM CHEMICAL CO LTD | 2012-11-14 | — | — | CN | claimed |
| CN-102731957-A | Thermoplastic abs resin compositions having excellent resistance to flame retardancy | LG CHEMICAL LTD | 2012-10-17 | — | — | CN | claimed |
| US-20200317976-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2020-10-08 | — | — | US | disclosed |
| EP-3458539-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | Monash University (AU) | 2019-03-27 | — | — | EP | disclosed |
| WO-2017197438-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2017-11-23 | — | — | WO | disclosed |
| CN-102776053-A | Composite extreme pressure anti-wear agent and total-synthesis anti-wear hydraulic oil containing same | SHANDONG YUANGEN PETROLEUM CHEMICAL CO LTD | 2012-11-14 | — | — | CN | disclosed |
| CN-102781968-A | Method for producing modified conjugated diene rubber, and rubber composition | JSR CORP | 2012-11-14 | — | — | CN | disclosed |
| CN-101336265-B | Water insoluble additive for improving conductivity of an ion exchange membrane | BDF IP HOLDINGS LTD | 2012-11-07 | — | — | CN | disclosed |
| CN-101796136-B | Resin composition and molded body using the same | UNITIKA LTD | 2012-09-26 | — | — | CN | disclosed |
| CN-102656233-A | Functionalized matrices for nanostructure dispersion | NANOSYS INC | 2012-09-05 | — | — | CN | disclosed |
| CN-102532483-A | Thermosetting resin compound containing carboxyl modified polyurethane resin | TOYO INK MFG CO | 2012-07-04 | — | — | CN | disclosed |
| CN-101463086-B | Diethoxy thiophosphate organophosphorus pesticide antibody, and preparation and use thereof | UNIV SOUTH CHINA AGRICULT | 2012-06-27 | — | — | CN | disclosed |
| CN-102449029-A | Polyamide resin, polyamide resin composition, and molded article comprising same | TORAY INDUSTRIES | 2012-05-09 | — | — | CN | disclosed |
| CN-102439064-A | Method for producing polyamide resin | TORAY INDUSTRIES | 2012-05-02 | — | — | CN | disclosed |
| CN-102320950-A | Method for synthesizing acetic acid through carbonylation | SHANGHAI HUAYI GROUP CO | 2012-01-18 | — | — | CN | disclosed |