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 SCHEMBL28240786 | 0.86 | — | — | |
| Diethylamine SCHEMBL27865996 | 0.86 | — | — | |
| Diethylamine SCHEMBL7368833 | 0.85 | — | — | |
| Diethylamine SCHEMBL3558785 | 0.85 | — | — | |
| Diethylamine SCHEMBL2698 | 0.85 | — | — | |
| Diethylamine SCHEMBL7130457 | 0.85 | TP53 (1.00) | — | |
| Diethylamine SCHEMBL9289074 | 0.80 | TP53 (0.89) | — | |
| Diethylamine SCHEMBL21585568 | 0.80 | — | — | |
| Diethylamine SCHEMBL1514723 | 0.80 | — | — | |
| Diethylamine SCHEMBL21980959 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110997631-B | High purity amphiphilic arylsulfonic acid amine salt vinyl monomers and (co) polymers thereof | 东曹精细化工株式会社 | 2022-07-15 | — | — | CN | disclosed |
| CN-114315665-A | Preparation method of 2-diethylaminoethanethiol and application of impurities thereof | 保定加合精细化工有限公司 | 2022-04-12 | — | — | CN | disclosed |
| CN-113307750-A | Process for producing aliphatic mercaptan | 保定北瑞甾体生物有限公司 | 2021-08-27 | — | — | CN | disclosed |
| WO-2020188839-A1 | NOVEL POLYSTYRENE-BASED POLYAMPHOLYTE HAVING UPPER CRITICAL SOLUTION TEMPERATURE, AND APPLICATION FOR SAME | 東ソー・ファインケム株式会社 | 2020-09-24 | — | — | WO | disclosed |
| WO-2012059797-A1 | PROCESS FOR SYNTHESIS OF (S) - PREGABALIN | LUPIN LIMITED (IN) | 2012-05-10 | — | — | WO | disclosed |
| CN-100593537-C | Method for synthesizing N,N-diethylin ethanethiol | YUNXIAN ZHAO | 2010-03-10 | — | — | CN | disclosed |
| CN-101481343-A | Method for synthesizing N,N-diethylamino ethanethiol | YUNXIAN ZHAO (CN) | 2009-07-15 | — | — | CN | disclosed |