⚠ 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 SCHEMBL3111692 | 0.99 | — | — | |
| SCHEMBL6550507 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL466316 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL15863813 | 0.75 | — | — | |
| SCHEMBL6435038 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL3112110 | 0.71 | — | — | |
| SCHEMBL8602543 | 0.70 | — | — | |
| SCHEMBL8602540 | 0.69 | — | — | |
| SCHEMBL6027599 | 0.66 | — | — | |
| SCHEMBL466315 | 0.65 | — | — |
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-0697419-B2 | Olefin polymerization catalyst and process for olefin polymerization | MITSUI CHEMICALS INC (JP) | 2004-12-01 | — | — | EP | disclosed |
| EP-0697419-B1 | Olefin polymerization catalyst and process for olefin polymerization | MITSUI CHEMICALS INC (JP) | 1999-05-06 | — | — | EP | disclosed |
| EP-0697419-A1 | Olefin polymerization catalyst and process for olefin polymerization | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-02-21 | — | — | EP | disclosed |