⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8157971 | 0.94 | TSHR (0.50) | — | |
| SCHEMBL1823097 | 0.94 | — | — | |
| SCHEMBL6323 | 0.94 | — | — | |
| SCHEMBL891350 | 0.94 | TSHR (0.50) | — | |
| SCHEMBL8049987 | 0.89 | — | — | |
| SCHEMBL8370114 | 0.89 | — | — | |
| SCHEMBL10572494 | 0.89 | — | — | |
| SCHEMBL20920815 | 0.89 | — | — | |
| Water SCHEMBL21456892 | 0.89 | — | — | |
| SCHEMBL2414020 | 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-0724603-A4 | AN OLEFIN POLYMERIZATION OR COPOLYMERIZATION CATALYST | MOBIL OIL CORP (US) | 1997-01-08 | — | — | EP | disclosed |
| EP-0724603-A1 | AN OLEFIN POLYMERIZATION OR COPOLYMERIZATION CATALYST | MOBIL OIL CORPORATION (US) | 1996-08-07 | — | — | EP | disclosed |
| WO-1995011263-A1 | AN OLEFIN POLYMERIZATION OR COPOLYMERIZATION CATALYST | MOBIL OIL CORPORATION (US) | 1995-04-27 | — | — | WO | disclosed |