⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL132441 | 0.87 | — | — | |
| SCHEMBL5617131 | 0.75 | — | — | |
| SCHEMBL16585939 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL29495946 | 0.75 | — | — | |
| SCHEMBL9388684 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28742468 | 0.67 | — | — | |
| Nitrogen SCHEMBL29118325 | 0.67 | — | — | |
| Bromide SCHEMBL11778844 | 0.67 | — | — | |
| SCHEMBL61080 | 0.58 | — | — | |
| Ethylene SCHEMBL2231763 | 0.58 | — | — |
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-20100197983-A1 | METHOD FOR THE PRODUCTION OF UNBRANCHED ACYCLIC OCTACTRIENES | OXENO OLEFINCHEMIE GMBH (DE) | 2010-08-05 | — | — | US | disclosed |
| US-7371909-B2 | Method for producing 1-olefins using palladium carbene compounds | OXENO OLEFINCHEMIE GMBH (DE) | 2008-05-13 | — | — | US | disclosed |
| US-20040242947-A1 | Method for producing 1-olefins using palladium-carbene compounds | EVONIK DEGUSSA GMBH (DE) | 2004-12-02 | — | — | US | disclosed |