⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL796734 | 0.67 | — | — | |
| SCHEMBL7638774 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL5598631 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL5506964 | 0.65 | — | — | |
| SCHEMBL24164671 | 0.64 | NOS2 (0.30) | — | |
| SCHEMBL6851049 | 0.63 | — | — | |
| SCHEMBL6856934 | 0.60 | — | — | |
| SCHEMBL22030590 | 0.60 | — | — | |
| SCHEMBL24972223 | 0.58 | — | — | |
| SCHEMBL4430872 | 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-6174972-B1 | CATALYTIC POLYMERIZATION OF OLEFINS WITH CYCLOPENTADIENE COMPOUNDS | BP CHEMICALS LIMITED (GB) | 2001-01-16 | — | — | US | disclosed |
| EP-0722955-B1 | Process for polymerising olefin | BP CHEM INT LTD (GB) | 1999-01-27 | — | — | EP | disclosed |
| EP-0722955-A1 | Process for polymerising olefin | BP Chemicals Limited (GB) | 1996-07-24 | — | — | EP | disclosed |