⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8664653 | 0.91 | — | — | |
| SCHEMBL8668212 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL4633231 | 0.75 | — | — | |
| Butadiene SCHEMBL8669758 | 0.74 | — | — | |
| SCHEMBL8667424 | 0.73 | — | — | |
| SCHEMBL8677855 | 0.73 | — | — | |
| SCHEMBL8667168 | 0.71 | — | — | |
| SCHEMBL8680599 | 0.71 | — | — | |
| SCHEMBL8670124 | 0.70 | — | — | |
| SCHEMBL8669734 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0767804-B1 | POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS | DOW CHEMICAL CO (US) | 1998-12-09 | — | — | EP | disclosed |
| US-5543480-A | USING GROUP 4 METAL COMPLEXES CONTAINING A DIENE MOIETY | THE DOW CHEMICAL COMPANY (US) | 1996-08-06 | — | — | US | disclosed |