⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8718095 | 0.82 | AOC3 (0.35) | — | |
| SCHEMBL8715292 | 0.79 | ALDH1A1 (0.31) | — | |
| SCHEMBL8714854 | 0.72 | MMP8 (0.33) | — | |
| SCHEMBL4961744 | 0.63 | — | — | |
| SCHEMBL8714357 | 0.61 | L3MBTL1 (0.32) | — | |
| SCHEMBL8718941 | 0.59 | IDO1 (0.31) | — | |
| SCHEMBL12077900 | 0.58 | IDO1 (0.31) | — | |
| SCHEMBL15735400 | 0.58 | — | — | |
| SCHEMBL29243058 | 0.57 | CES2 (0.38) | — | |
| SCHEMBL10245033 | 0.56 | CES2 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5744678-A | NICKEL COMPOUND, ORGANOPHOSPHORUS COMPOUND, ORGANOALUMINUM COMPOUND, CARBON-HALOGEN COMPOUNDS; CATALYST SELECTIVITY | NIPPON OIL CO., LTD. (JP) | 1998-04-28 | — | — | US | disclosed |
| EP-0758563-A1 | OLEFIN OLIGOMERIZATION CATALYST AND PROCESS FOR THE PREPARATION OF OLEFIN OLIGOMER USING IT | NIPPON OIL COMPANY, LTD. (JP) | 1997-02-19 | — | — | EP | disclosed |