⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21497267 | 0.75 | — | — | |
| SCHEMBL21495999 | 0.74 | — | — | |
| SCHEMBL21496136 | 0.73 | — | — | |
| SCHEMBL2768154 | 0.73 | — | — | |
| SCHEMBL21496025 | 0.70 | — | — | |
| SCHEMBL21495992 | 0.69 | — | — | |
| SCHEMBL2900666 | 0.67 | — | — | |
| SCHEMBL21495978 | 0.67 | — | — | |
| SCHEMBL21496004 | 0.63 | — | — | |
| SCHEMBL21496137 | 0.62 | — | — |
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-110799573-B | Photochromic polyrotaxane compound, and curable composition comprising same | 株式会社德山 | 2022-06-03 | — | — | CN | disclosed |
| CN-112424260-A | Photochromic compound and curable composition containing same | 株式会社德山 | 2021-02-26 | — | — | CN | disclosed |
| CN-110869355-A | Benzopyran compound, curable composition containing benzopyran compound, and optical article containing cured product formed from curable composition | 株式会社德山 | 2020-03-06 | — | — | CN | disclosed |
| CN-110799573-A | Photochromic polyrotaxane compound, and curable composition comprising same | 株式会社德山 | 2020-02-14 | — | — | CN | disclosed |
| WO-2019203205-A1 | PHOTOCHROMIC COMPOUND, CURABLE COMPOSITION CONTAINING SAID PHOTOCHROMIC COMPOUND, AND OPTICAL ARTICLE | 株式会社トクヤマ | 2019-10-24 | — | — | WO | disclosed |