⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5864504 | 0.91 | — | — | |
| SCHEMBL5864427 | 0.86 | — | — | |
| SCHEMBL5864401 | 0.81 | — | — | |
| SCHEMBL6905771 | 0.81 | HTR2A (0.34) | — | |
| Methyl Alcohol SCHEMBL11305813 | 0.81 | NOS3 (0.33) | — | |
| SCHEMBL5864339 | 0.76 | SIGMAR1 (0.32) | — | |
| SCHEMBL5864305 | 0.76 | — | — | |
| SCHEMBL5864299 | 0.74 | HTR2A (0.30) | — | |
| SCHEMBL15012490 | 0.73 | — | — | |
| SCHEMBL15012758 | 0.73 | — | — |
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-1066337-B1 | OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS | CHEVRON PHILLIPS CHEMICAL CO (US) | 2004-11-03 | — | — | EP | claimed |
| US-7097890-B1 | Polymer with pendent cyclic olefinic functions for oxygen scavenging packaging | CHEVRON PHILLIPS CHEMICAL CO. LP (US) | 2006-08-29 | — | — | US | disclosed |
| EP-1066337-B1 | OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS | CHEVRON PHILLIPS CHEMICAL CO (US) | 2004-11-03 | — | — | EP | disclosed |