⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29720342 | 0.74 | — | — | |
| SCHEMBL6688901 | 0.74 | — | — | |
| SCHEMBL28675880 | 0.74 | — | — | |
| SCHEMBL9197149 | 0.74 | — | — | |
| SCHEMBL15841536 | 0.70 | FKBP5 (0.38) | — | |
| SCHEMBL15841535 | 0.70 | FKBP5 (0.38) | — | |
| SCHEMBL19678163 | 0.70 | CYP1A2 (0.33) | — | |
| SCHEMBL28495107 | 0.70 | — | — | |
| SCHEMBL9838837 | 0.70 | — | — | |
| SCHEMBL9838835 | 0.70 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103833561-A | Method for N-arylation of alkane amine | UNIV HENGYANG NORMAL | 2014-06-04 | — | — | CN | claimed |
| WO-2024013736-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZAMIDES | ADAMA MAKHTESHIM LTD. (IL) | 2024-01-18 | — | — | WO | disclosed |
| CN-114751943-B | Pyridine-2-aldehyde (ketone) oxime/cobalt complex, preparation method thereof and application thereof in conjugated diene polymerization | 中国科学院青岛生物能源与过程研究所 | 2023-06-23 | — | — | CN | disclosed |
| CN-103833561-B | The N-arylation method of alkane amine | HENGYANG NORMAL UNIVERSITY (CN) | 2016-01-13 | — | — | CN | disclosed |
| CN-103833561-B | The N-arylation method of alkane amine | HENGYANG NORMAL UNIVERSITY (CN) | 2016-01-13 | — | — | CN | disclosed |
| CN-103833561-A | Method for N-arylation of alkane amine | UNIV HENGYANG NORMAL | 2014-06-04 | — | — | CN | disclosed |
| EP-0291673-B1 | TETRAHYDROPYRIDINE OXIMES, A PROCESS FOR THEIR PREPARATION AND USE THEREOF AS CHOLINERGIC AGENTS | WARNER-LAMBERT COMPANY (US) | 1993-06-02 | — | — | EP | disclosed |
| EP-0291673-A1 | Tetrahydropyridine oximes, a process for their preparation and use thereof as cholinergic agents | WARNER-LAMBERT COMPANY (US) | 1988-11-23 | — | — | EP | disclosed |
| US-4379787-A | ANTIBIOTICS | ELI LILLY AND COMPANY (US) | 1983-04-12 | — | — | US | disclosed |