⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL593685 | 0.84 | — | — | |
| SCHEMBL1577138 | 0.70 | — | — | |
| SCHEMBL3752001 | 0.67 | — | — | |
| SCHEMBL17385592 | 0.65 | — | — | |
| SCHEMBL3749037 | 0.65 | — | — | |
| SCHEMBL331436 | 0.63 | — | — | |
| SCHEMBL1781040 | 0.61 | — | — | |
| SCHEMBL1402903 | 0.59 | — | — | |
| SCHEMBL1577446 | 0.59 | — | — | |
| SCHEMBL15259778 | 0.59 | — | — |
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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111989382-B | Photochromic compound, curable composition containing the same, and optical article | 株式会社德山 | 2024-01-05 | — | — | CN | disclosed |
| CN-110799573-B | Photochromic polyrotaxane compound, and curable composition comprising same | 株式会社德山 | 2022-06-03 | — | — | CN | disclosed |
| CN-111154056-B | Optical composition containing polyrotaxane | 株式会社德山 | 2021-12-21 | — | — | CN | disclosed |
| EP-2123695-B1 | METAL THIETANE COMPOUND, POLYMERIZABLE COMPOSITION COMPRISING THE COMPOUND, RESIN, AND USE OF THE RESIN | MITSUI CHEMICALS INC (JP) | 2021-06-23 | — | — | EP | disclosed |
| CN-112424260-A | Photochromic compound and curable composition containing same | 株式会社德山 | 2021-02-26 | — | — | CN | disclosed |
| CN-107922605-B | Polyrotaxane, process for producing the same, and optical composition containing the same | 株式会社德山 | 2020-12-11 | — | — | CN | disclosed |
| CN-107207851-B | Method for producing photochromic cured product | 株式会社德山 | 2020-07-17 | — | — | CN | disclosed |
| CN-111154056-A | Optical composition containing polyrotaxane | 株式会社德山 | 2020-05-15 | — | — | CN | disclosed |
| CN-110799573-A | Photochromic polyrotaxane compound, and curable composition comprising same | 株式会社德山 | 2020-02-14 | — | — | CN | disclosed |
| US-10472435-B2 | Polymerizable composition and novel alkyne compound | MITSUI CHEMICALS, INC. (JP) | 2019-11-12 | — | — | US | disclosed |
| EP-2292597-A1 | METAL COMPOUND, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN, METHOD FOR PRODUCING THE RESIN AND USE OF THE RESIN | Mitsui Chemicals, Inc. (JP) | 2011-03-09 | — | — | EP | disclosed |
| US-20100298519-A1 | POLYMERIZABLE COMPOSITION, AND RESIN AND OPTICAL PART USING THE SAME | MITSUI CHEMICALS, INC. (JP) | 2010-11-25 | — | — | US | disclosed |
| EP-2253626-A1 | THIETANE COMPOUND, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN, METHOD FOR PRODUCING THE RESIN, AND USE OF THE RESIN | Mitsui Chemicals, Inc. (JP) | 2010-11-24 | — | — | EP | disclosed |
| US-20100286334-A1 | ADDITIVE FOR POLYMERIZABLE COMPOSITION, POLYMERIZABLE COMPOSITION CONTAINING THE SAME AND USE OF THE POLYMERIZABLE COMPOSITION | MITSUI CHEMICALS, INC. (JP) | 2010-11-11 | — | — | US | disclosed |
| US-20100240862-A1 | METAL THIETANE COMPOUND, POLYMERIZABLE COMPOSITION CONTAINING THE COMPOUND, RESIN AND USE OF THE RESIN | MITSUI CHEMICALS, INC. (JP) | 2010-09-23 | — | — | US | disclosed |
| EP-2230271-A1 | ADDITIVE FOR POLYMERIZABLE COMPOSITION, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, AND USE OF THE POLYMERIZABLE COMPOSITION | Mitsui Chemicals, Inc. (JP) | 2010-09-22 | — | — | EP | disclosed |
| US-20100063246-A1 | POLYMERIZABLE COMPOSITION, RESIN USING THE SAME, OPTICAL COMPONENT AND LENS | MITSUI CHEMICALS, INC. (JP) | 2010-03-11 | — | — | US | disclosed |
| EP-2123695-A1 | METAL THIETANE COMPOUND, POLYMERIZABLE COMPOSITION COMPRISING THE COMPOUND, RESIN, AND USE OF THE RESIN | Mitsui Chemicals, Inc. (JP) | 2009-11-25 | — | — | EP | disclosed |
| EP-2036951-A1 | POLYMERIZABLE COMPOSITION, RESIN USING THE SAME, OPTICAL COMPONENT AND LENS | Mitsui Chemicals, Inc. (JP) | 2009-03-18 | — | — | EP | disclosed |
| EP-2014700-A1 | POLYMERIZABLE COMPOSITION, RESIN USING THE SAME AND OPTICAL COMPONENT | Mitsui Chemicals, Inc. (JP) | 2009-01-14 | — | — | EP | disclosed |