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 SCHEMBL27864415 | 1.00 | — | — | |
| Diethylamine SCHEMBL9701031 | 0.95 | TP53 (0.89) | — | |
| Diethylamine SCHEMBL1332127 | 0.95 | — | — | |
| Diethylamine SCHEMBL9701034 | 0.95 | — | — | |
| Diethylamine SCHEMBL8747825 | 0.95 | — | — | |
| Diethylamine SCHEMBL124914 | 0.95 | — | — | |
| Diethylamine SCHEMBL2869417 | 0.95 | TP53 (0.89) | — | |
| Diethylamine SCHEMBL5321340 | 0.95 | — | — | |
| Diethylamine SCHEMBL19856521 | 0.95 | TP53 (0.89) | — | |
| Diethylamine SCHEMBL29019634 | 0.95 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102712699-A | Cassia derivatives | LUBRIZOL ADVANCED MAT INC | 2012-10-03 | — | — | CN | disclosed |
| CN-101605829-B | Polymer and method of making same | UNILEVER PLC | 2012-05-23 | — | — | CN | disclosed |
| CN-101607924-B | Method for preparing partial substituted alkyl urea series compounds | BEIJING INST FASHION TECH | 2012-05-23 | — | — | CN | disclosed |
| CN-101679303-B | Pyridazinone derivatives | MERCK PATENT GMBH | 2012-05-09 | — | — | CN | disclosed |