⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8675290 | 0.98 | — | — | |
| SCHEMBL6401441 | 0.80 | — | — | |
| Methoxymethane SCHEMBL28440271 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL5513826 | 0.79 | — | — | |
| SCHEMBL814371 | 0.78 | — | — | |
| SCHEMBL8163376 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL615522 | 0.76 | — | — | |
| SCHEMBL3838165 | 0.76 | — | — | |
| Fluoride SCHEMBL1130770 | 0.76 | — | — | |
| SCHEMBL4480863 | 0.75 | — | — |
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-0608054-B1 | Catalyst compositions and process for preparing polyolefins | BP CHEM INT LTD (GB) | 1999-07-07 | — | — | EP | disclosed |
| US-5814574-A | ZIRCONIUM METALLOCENE POLYMERIZATION CATALYSTS; NARROW MOLECULAR WEIGHT DISTRIBUTION | BP CHEMICALS LIMITED (GB) | 1998-09-29 | — | — | US | disclosed |
| US-5767209-A | A METALLOCENE COMPLEX OF A GROUP 4 METAL AND A CYCLOPENTADIENYL NUCLEUS ON AN INORGANIC SUPPORT WITHOUT USING COCATALYSTS, E.G. ALUMOXANES, AS THE MEANS OF SUPPORT | BP CHEMICALS LIMITED (GB) | 1998-06-16 | — | — | US | disclosed |
| EP-0608054-A2 | Catalyst compositions and process for preparing polyolefins | BP Chemicals Limited (GB) | 1994-07-27 | — | — | EP | disclosed |