⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30996161 | 0.98 | — | — | |
| SCHEMBL31321402 | 0.88 | — | — | |
| SCHEMBL25807332 | 0.86 | — | — | |
| SCHEMBL13186869 | 0.85 | — | — | |
| SCHEMBL30668362 | 0.84 | — | — | |
| SCHEMBL15360420 | 0.84 | — | — | |
| SCHEMBL26538824 | 0.84 | — | — | |
| SCHEMBL25970905 | 0.83 | — | — | |
| SCHEMBL8589554 | 0.82 | — | — | |
| SCHEMBL19616458 | 0.82 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112188954-B | Automatic injection method of mold for monomer for thiourethane optical material | 可奥熙搜路司有限公司 | 2023-04-07 | — | — | CN | claimed |
| CN-116554434-A | Diisocyanate composition for optical lenses and method for preparing the same | SKC株式会社 | 2023-08-08 | — | — | CN | disclosed |
| CN-112920082-B | Diisocyanate composition, method for preparing the same, and optical material using the same | SKC株式会社 | 2023-06-23 | — | — | CN | disclosed |
| CN-112920374-B | Diisocyanate composition for optical lenses and method for preparing the same | SKC株式会社 | 2023-05-30 | — | — | CN | disclosed |
| CN-112920375-B | Method for preparing diisocyanate composition and optical lens | SKC株式会社 | 2023-05-12 | — | — | CN | disclosed |
| CN-112920373-B | Diisocyanate composition, method for preparing the same, and optical material using the same | SKC株式会社 | 2023-05-12 | — | — | CN | disclosed |
| CN-112920372-B | Method for preparing diisocyanate composition and optical lens | SKC株式会社 | 2023-05-12 | — | — | CN | disclosed |
| CN-112920371-B | Process for preparing diisocyanate compositions | SKC株式会社 | 2023-05-12 | — | — | CN | disclosed |
| CN-112920370-B | Method for preparing diisocyanate composition and optical lens | SKC株式会社 | 2023-05-12 | — | — | CN | disclosed |
| CN-116018336-A | Process for the preparation of isocyanate compounds comprising non-chlorinated derivatives and compositions thereof | KS试验研究株式会社 | 2023-04-25 | — | — | CN | disclosed |
| CN-112543776-B | Polymerizable composition and optical material prepared from same | SKC株式会社 | 2023-04-04 | — | — | CN | disclosed |
| CN-112920084-B | Diamine composition and process for preparing diisocyanate composition | SKC株式会社 | 2023-01-17 | — | — | CN | disclosed |
| CN-112118955-B | Automatic injection method of mold for monomer for episulfide optical material | 可奥熙搜路司有限公司 | 2022-04-19 | — | — | CN | disclosed |