⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6908556 | 0.67 | — | — | |
| SCHEMBL17556639 | 0.67 | POLB (0.35) | — | |
| SCHEMBL6908694 | 0.65 | L3MBTL1 (0.34) | — | |
| SCHEMBL2990913 | 0.65 | — | — | |
| SCHEMBL2994624 | 0.65 | — | — | |
| SCHEMBL6910581 | 0.64 | — | — | |
| SCHEMBL17239392 | 0.63 | NOS3 (0.30) | — | |
| SCHEMBL17239391 | 0.63 | NOS3 (0.30) | — | |
| SCHEMBL14137725 | 0.63 | — | — | |
| SCHEMBL14954535 | 0.59 | NOS1 (0.30) | — |
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 1 patent. 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 |