⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9705161 | 1.00 | — | — | |
| SCHEMBL10354097 | 0.93 | PDE4D (0.30) | — | |
| SCHEMBL9703064 | 0.89 | PDE4D (0.31) | — | |
| SCHEMBL9703063 | 0.89 | PDE4D (0.31) | — | |
| SCHEMBL10634009 | 0.85 | ALDH1A1 (0.33) | — | |
| SCHEMBL9702609 | 0.80 | — | — | |
| SCHEMBL9702613 | 0.80 | — | — | |
| SCHEMBL9703199 | 0.78 | PTGIR (0.33) | — | |
| SCHEMBL9703201 | 0.78 | PTGIR (0.33) | — | |
| SCHEMBL20536873 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5175338-A | Anticoagulants, vasodilation, antilipemic agents | TEIJIN LIMITED (JP) | 1992-12-29 | — | — | US | disclosed |
| US-4788319-A | PROSTAGLANDIN INTERMEDIATES | TEIJIN LIMITED (JP) | 1988-11-29 | — | — | US | disclosed |
| EP-0247740-A2 | Novel isocarbacyclins and processes for production thereof | TEIJIN LIMITED (JP) | 1987-12-02 | — | — | EP | disclosed |