⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8073752 | 0.82 | — | — | |
| SCHEMBL19875133 | 0.71 | — | — | |
| SCHEMBL19875111 | 0.71 | — | — | |
| SCHEMBL28441673 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL17633740 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL19874980 | 0.67 | — | — | |
| SCHEMBL19874961 | 0.67 | — | — | |
| SCHEMBL7169327 | 0.66 | TAAR1 (0.32) | — | |
| SCHEMBL19875046 | 0.64 | — | — | |
| SCHEMBL819299 | 0.63 | ALDH1A1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1141044-A1 | SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER | Basell Technology Company B.V. (NL) | 2001-10-10 | — | — | EP | disclosed |
| WO-2001036496-A1 | SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER | BASELL TECHNOLOGY COMPANY B.V. (NL) | 2001-05-25 | — | — | WO | disclosed |