⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26758040 | 0.97 | — | — | |
| SCHEMBL25360611 | 0.89 | — | — | |
| SCHEMBL460834 | 0.89 | — | — | |
| SCHEMBL28790864 | 0.85 | — | — | |
| SCHEMBL7620485 | 0.83 | — | — | |
| SCHEMBL11597227 | 0.82 | — | — | |
| SCHEMBL12447683 | 0.82 | — | — | |
| SCHEMBL26758045 | 0.82 | — | — | |
| SCHEMBL26702540 | 0.80 | — | — | |
| SCHEMBL22420339 | 0.78 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112513012-B | Novel allyl compound and composition for optical material | 三菱瓦斯化学株式会社 | 2022-09-20 | — | — | CN | disclosed |
| CN-107735429-B | Photocurable composition and optical material | 三菱瓦斯化学株式会社 | 2021-05-07 | — | — | CN | disclosed |
| CN-112513012-A | Novel allyl compound and composition for optical material | 三菱瓦斯化学株式会社 | 2021-03-16 | — | — | CN | disclosed |
| CN-107735428-B | Composition for optical material and optical material using same | 三菱瓦斯化学株式会社 | 2020-12-04 | — | — | CN | disclosed |
| CN-107709411-B | Composition for optical material and optical material | 三菱瓦斯化学株式会社 | 2020-05-12 | — | — | CN | disclosed |