⚠ 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 | |
|---|---|---|---|---|
| Chloroform SCHEMBL2571706 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL9526391 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL5747359 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL888275 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL48119 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL9568279 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL3207413 | 0.80 | LMNA (0.57) | — | |
| Chloroform SCHEMBL9525441 | 0.80 | LMNA (0.57) | — | |
| 1,1,2,2-Tetrachloroethane SCHEMBL11666833 | 0.80 | — | — | |
| Chloroform SCHEMBL9037829 | 0.80 | LMNA (0.57) | — |
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-117624239-A | Cytidine derivatives and process for preparing same | 中国人民解放军军事科学院军事医学研究院 | 2024-03-01 | — | — | CN | disclosed |
| CN-107922391-B | Pyridine and pyrimidine derivatives | 豪夫迈·罗氏有限公司 | 2020-09-25 | — | — | CN | disclosed |
| EP-3334727-B1 | PYRIDINE AND PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2019-05-15 | — | — | EP | disclosed |
| US-10005736-B1 | Pyridine and pyrimidine derivatives | HOFFMAN-LA ROCHE INC. (US) | 2018-06-26 | — | — | US | disclosed |
| EP-3334727-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES | H. Hoffnabb-La Roche Ag (CH) | 2018-06-20 | — | — | EP | disclosed |
| US-20180162824-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2018-06-14 | — | — | US | disclosed |
| CN-107922391-A | Pyridine and pyrimidine derivatives | 豪夫迈·罗氏有限公司 | 2018-04-17 | — | — | CN | disclosed |
| WO-2017025523-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2017-02-16 | — | — | WO | disclosed |
| US-20040249148-A1 | Imidazotriazines for use as phosphodiesterase inhibitors | BAYER HEALTHCARE AG (DE) | 2004-12-09 | — | — | US | disclosed |