⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21495991 | 0.89 | — | — | |
| SCHEMBL20609094 | 0.89 | — | — | |
| SCHEMBL28525501 | 0.82 | — | — | |
| SCHEMBL21669705 | 0.79 | — | — | |
| SCHEMBL21670100 | 0.78 | — | — | |
| SCHEMBL21753743 | 0.77 | — | — | |
| SCHEMBL17103791 | 0.76 | — | — | |
| SCHEMBL21657154 | 0.76 | — | — | |
| SCHEMBL433120 | 0.75 | — | — | |
| SCHEMBL21632451 | 0.75 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3351573-B1 | MOLDED BODY AND POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS | MITSUI CHEMICALS INC (JP) | 2020-06-17 | — | — | EP | claimed |
| EP-2128178-B1 | RESIN COMPOSITION FOR OPTICAL MEMBER AND OPTICAL MEMBER OBTAINED FROM THE SAME | MITSUBISHI GAS CHEMICAL CO (JP) | 2013-04-24 | — | — | EP | claimed |
| EP-2128178-A1 | RESIN COMPOSITION FOR OPTICAL MEMBER AND OPTICAL MEMBER OBTAINED FROM THE SAME | Mitsubishi Gas Chemical Company, Inc. (JP) | 2009-12-02 | — | — | EP | claimed |
| US-10954341-B2 | Polymerizable composition for optical material, optical material, process for preparing polymerizable composition for optical material, and method of manufacturing optical material | MITSUI CHEMICALS, INC. (JP) | 2021-03-23 | — | — | US | disclosed |
| EP-3444236-B1 | XYLYLENEDIISOCYANATE COMPOSITION, RESIN, AND POLYMERIZABLE COMPOSITION | MITSUI CHEMICALS INC (JP) | 2020-12-30 | — | — | EP | disclosed |
| US-20180340044-A1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, PROCESS FOR PREPARING POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND METHOD OF MANUFACTURING OPTICAL MATERIAL | MITSUI CHEMICALS, INC. (JP) | 2018-11-29 | — | — | US | disclosed |
| EP-3155031-A1 | POLYISOCYANATES HAVING THIOALLOPHANATE STRUCTURE | Covestro Deutschland AG (DE) | 2017-04-19 | — | — | EP | disclosed |
| US-9477012-B2 | 1,4-bis(isocyanatomethyl)cyclohexane, polyisocyanate composition, polyurethane resin, molded article, eyewear material, eyewear frame, and lens | MITSUI CHEMICALS, INC. (JP) | 2016-10-25 | — | — | US | disclosed |
| WO-2015189169-A1 | POLYISOCYANATES HAVING THIOALLOPHANATE STRUCTURE | COVESTRO DEUTSCHLAND AG (DE) | 2015-12-17 | — | — | WO | disclosed |
| US-20150346387-A1 | 1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, MOLDED ARTICLE, EYEWEAR MATERIAL, EYEWEAR FRAME, AND LENS | MITSUI CHEMICALS, INC. (JP) | 2015-12-03 | — | — | US | disclosed |
| US-9051293-B2 | Process for preparing episulfide compounds | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2015-06-09 | — | — | US | disclosed |
| US-20140107350-A1 | Process for Preparing Episulfide Compounds | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2014-04-17 | — | — | US | disclosed |
| US-8187712-B2 | Plastic polarized lens and method of producing the same | MITSUI CHEMICALS, INC. (JP) | 2012-05-29 | — | — | US | disclosed |
| EP-2128178-A1 | RESIN COMPOSITION FOR OPTICAL MEMBER AND OPTICAL MEMBER OBTAINED FROM THE SAME | Mitsubishi Gas Chemical Company, Inc. (JP) | 2009-12-02 | — | — | EP | disclosed |