⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31483251 | 0.78 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL31483254 | 0.78 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL9647195 | 0.77 | LMNA (0.34) | — | |
| SCHEMBL5153254 | 0.67 | — | — | |
| SCHEMBL6308345 | 0.66 | — | — | |
| SCHEMBL8445390 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL28648069 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL2678647 | 0.64 | — | — | |
| SCHEMBL18793690 | 0.64 | NOS1 (0.31) | — | |
| SCHEMBL18596273 | 0.64 | TLR8 (0.32) | — |
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-104387377-B | A kind of preparation method of thiazole methylamine yl pyridines class compound | 湖南海利常德农药化工有限公司 | 2017-03-29 | — | — | CN | claimed |
| CN-105753779-B | 2- pyridyl amine compounds and preparation method and application | 湖南化工研究院有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-104387377-B | A kind of preparation method of thiazole methylamine yl pyridines class compound | 湖南海利常德农药化工有限公司 | 2017-03-29 | — | — | CN | disclosed |
| CN-105753779-A | 2-pyridylamine compounds, preparing method thereof and applications of the compounds | 湖南化工研究院有限公司 | 2016-07-13 | — | — | CN | disclosed |