⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5715787 | 0.81 | — | — | |
| SCHEMBL6443411 | 0.80 | — | — | |
| SCHEMBL5716400 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL5716034 | 0.77 | — | — | |
| SCHEMBL5716570 | 0.75 | — | — | |
| SCHEMBL5715529 | 0.74 | — | — | |
| SCHEMBL6440781 | 0.72 | SOAT1 (0.32) | — | |
| SCHEMBL5716299 | 0.72 | SOAT1 (0.32) | — | |
| SCHEMBL5716154 | 0.72 | DPP4 (0.33) | — | |
| SCHEMBL5716011 | 0.71 | ALDH1A1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1252166-B1 | OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM | EXXONMOBIL CHEM PATENTS INC (US) | 2005-11-09 | — | — | EP | disclosed |