Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| Monoethanolamine SCHEMBL540866 | 0.88 | TSHR (0.44) | — | |
| Ethylamine SCHEMBL3467386 | 0.88 | — | — | |
| Ethylamine SCHEMBL27588741 | 0.85 | CA2 (0.40) | — | |
| Alcohol SCHEMBL27553856 | 0.84 | — | — | |
| Hydrazine SCHEMBL679587 | 0.83 | — | — | |
| Methylamine SCHEMBL143865 | 0.83 | — | — | |
| Hydroxyamine SCHEMBL27900806 | 0.83 | — | — | |
| SCHEMBL5991 | 0.83 | — | — | |
| SCHEMBL27346657 | 0.83 | TSHR (0.50) | — | |
| SCHEMBL27259142 | 0.83 | TSHR (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114514251-A | Polymer dispersions and fabric conditioning compositions comprising the same | 罗地亚经营管理公司 | 2022-05-17 | — | — | CN | disclosed |
| EP-1969111-A1 | MALODOR REDUCING COMPOSITIONS AND METHODS | Colgate-Palmolive Company (US) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007059532-A1 | MALODOR REDUCING COMPOSITIONS AND METHODS | COLGATE-PALMOLIVE COMPANY (US) | 2007-05-24 | — | — | WO | disclosed |