⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14925296 | 1.00 | — | — | |
| SCHEMBL13287711 | 1.00 | — | — | |
| SCHEMBL12198815 | 1.00 | — | — | |
| SCHEMBL12302807 | 1.00 | — | — | |
| SCHEMBL12198817 | 1.00 | — | — | |
| SCHEMBL12198823 | 1.00 | — | — | |
| SCHEMBL13728062 | 0.85 | — | — | |
| SCHEMBL12574591 | 0.78 | — | — | |
| SCHEMBL12302806 | 0.76 | — | — | |
| SCHEMBL12427219 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0741127-B1 | Synthesis of cyanoacrylate esters by oxidation of aromatic selenyl cyanopropionates | LOCTITE CORP (US) | 1999-04-07 | — | — | EP | disclosed |
| EP-0741127-A1 | Synthesis of cyanoacrylate esters by oxidation of aromatic selenyl cyanopropionates | LOCTITE CORPORATION (US) | 1996-11-06 | — | — | EP | disclosed |
| US-5504252-A | Synthesis of cyanoacrylate esters by oxidation of aromatic selenyl cyanopropionates | LOCTITE CORPORATION (US) | 1996-04-02 | — | — | US | disclosed |
| US-5386047-A | Monomers for heat resistant, high bonding strength cyanoacrylate adhesives | LOCTITE CORPORATION (US) | 1995-01-31 | — | — | US | disclosed |