⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7418086 | 0.83 | PDE8A (0.43) | — | |
| SCHEMBL509733 | 0.79 | — | — | |
| SCHEMBL29774155 | 0.79 | — | — | |
| SCHEMBL1507045 | 0.77 | — | — | |
| SCHEMBL5955760 | 0.77 | — | — | |
| SCHEMBL510676 | 0.77 | — | — | |
| SCHEMBL379949 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL31198157 | 0.77 | PDE8A (0.39) | — | |
| SCHEMBL17103357 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL1157373 | 0.77 | PDE8A (0.39) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7314940-B2 | For therapy and prophylaxis of neurodegenerative disorders related to apoptosis and/or inflammation | EISAI CO., LTD. (JP) | 2008-01-01 | — | — | US | disclosed |
| EP-1373269-B1 | JUN KINASE INHIBITORS | EISAI CO LTD (JP) | 2005-06-08 | — | — | EP | disclosed |
| US-20040235864-A1 | Jun kinase inhibitors | EISAI R & D MANAGEMENT CO., LTD. (JP) | 2004-11-25 | — | — | US | disclosed |
| EP-1373269-A1 | JUN KINASE INHIBITORS | Eisai Co., Ltd. (JP) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002081475-A1 | JUN KINASE INHIBITORS | EISAI CO., LIMITED (JP) | 2002-10-17 | — | — | WO | disclosed |