⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8144244 | 0.94 | — | — | |
| SCHEMBL17221 | 0.94 | — | — | |
| SCHEMBL9202049 | 0.94 | — | — | |
| SCHEMBL9561672 | 0.89 | — | — | |
| SCHEMBL18050339 | 0.89 | — | — | |
| SCHEMBL3113700 | 0.89 | — | — | |
| SCHEMBL5005487 | 0.89 | — | — | |
| SCHEMBL465445 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL6245399 | 0.89 | — | — | |
| SCHEMBL7747732 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0702665-B1 | PROCESS FOR PRODUCING 1,4-DIENES | EXXON CHEMICAL PATENTS INC (US) | 2000-08-09 | — | — | EP | disclosed |
| US-5430213-A | Reacting conjugated diene and alpha olefin using catalyst containing cobalt, a tertiary diphposphine and organoaluminum compound | EXXON CHEMICAL PATENTS INC. (US) | 1995-07-04 | — | — | US | disclosed |
| WO-1994026682-A1 | PROCESS FOR PRODUCING 1,4-DIENES | EXXON CHEMICAL PATENTS INC. (US) | 1994-11-24 | — | — | WO | disclosed |