⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL629382 | 0.86 | — | — | |
| SCHEMBL6684720 | 0.80 | — | — | |
| SCHEMBL7931829 | 0.65 | — | — | |
| SCHEMBL10797075 | 0.65 | — | — | |
| SCHEMBL11406677 | 0.65 | ALDH1A1 (0.40) | — | |
| SCHEMBL30091 | 0.65 | — | — | |
| SCHEMBL5499984 | 0.63 | — | — | |
| Methoxymethane SCHEMBL28285262 | 0.62 | — | — | |
| SCHEMBL28091698 | 0.62 | — | — | |
| SCHEMBL3476209 | 0.61 | — | — |
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-5075270-A | Coordination catalyst for polymerization of alpha-olefins | ATOCHEM (FR) | 1991-12-24 | — | — | US | disclosed |
| EP-0206893-B1 | PROCESS FOR PREPARING A TRANSISTION METAL COMPONENT FOR AN OLEFIN POLYMERIZATION CATALYTIC SYSTEM | ELF ATOCHEM S.A. (FR) | 1989-12-06 | — | — | EP | disclosed |
| EP-0206893-A1 | Process for preparing a transistion metal component for an olefin polymerization catalytic system | ELF ATOCHEM S.A. (FR) | 1986-12-30 | — | — | EP | disclosed |