⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20609089 | 0.89 | — | — | |
| SCHEMBL21495991 | 0.81 | — | — | |
| SCHEMBL26120392 | 0.81 | — | — | |
| SCHEMBL17103791 | 0.79 | — | — | |
| SCHEMBL8733915 | 0.79 | — | — | |
| SCHEMBL21657156 | 0.78 | — | — | |
| SCHEMBL21657046 | 0.76 | — | — | |
| SCHEMBL4368283 | 0.75 | — | — | |
| SCHEMBL28525501 | 0.73 | — | — | |
| SCHEMBL4458546 | 0.71 | — | — |
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 18 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 |
| US-20180224576-A1 | POLYMERIZABLE COMPOSITION FOR PLASTIC LENS AND METHOD OF PREPARING PLASTIC LENS USING SAME | SKC CO., LTD. (KR) | 2018-08-09 | — | — | US | claimed |
| EP-2899188-B1 | METHOD FOR STORING EPISULFIDE COMPOUND AND METHOD FOR PREPARING THIOEPOXY-BASED OPTICAL MATERIAL USING SAID EPISULFIDE COMPOUND | KOC SOLUTION CO LTD (KR) | 2020-01-08 | — | — | EP | disclosed |
| EP-2796907-B1 | POLARIZING LENS AND METHOD FOR PRODUCING SAME | EHS LENS PHILIPPINES INC (PH) | 2019-01-02 | — | — | EP | disclosed |
| US-9527948-B2 | Polymerizable composition, optical article obtained therefrom and method for the production of said optical article | MITSUI CHEMICALS, INC. (JP) | 2016-12-27 | — | — | US | disclosed |
| US-9475903-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 |
| US-20150342276-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-20140327869-A1 | POLYMERIZABLE COMPOSITION, OPTICAL ARTICLE OBTAINED THEREFROM AND METHOD FOR THE PRODUCTION OF SAID OPTICAL ARTICLE | MITSUI CHEMICALS, INC. | 2014-11-06 | — | — | US | disclosed |
| EP-2596040-A1 | POLYURETHANE HAVING LOW VOLUME SHRINKAGE | Bayer Intellectual Property GmbH (DE) | 2013-05-29 | — | — | EP | disclosed |
| EP-2596042-A1 | POLYISOCYANATE MIXTURES | Bayer Intellectual Property GmbH (DE) | 2013-05-29 | — | — | EP | disclosed |
| WO-2012010524-A1 | POLYURETHANE HAVING LOW VOLUME SHRINKAGE | BAYER MATERIALSCIENCE AG (DE) | 2012-01-26 | — | — | WO | disclosed |
| WO-2012010523-A1 | POLYISOCYANATE MIXTURES | BAYER MATERIALSCIENCE AG (DE) | 2012-01-26 | — | — | WO | disclosed |
| EP-2389405-A1 | POLYURETHANE CASTING COMPOUNDS | Bayer MaterialScience AG (DE) | 2011-11-30 | — | — | EP | disclosed |
| EP-2389403-A1 | POLYURETHANE SEALING COMPOUNDS | Bayer MaterialScience AG (DE) | 2011-11-30 | — | — | EP | disclosed |
| US-20110257454-A1 | Use of an Additive in the Coupling of Toluene with a Carbon Source | FINA TECHNOLOGY, INC. (US) | 2011-10-20 | — | — | US | disclosed |
| US-20110255211-A1 | HIGHLY DIELECTRIC FILM | DAIKIN INDUSTRIES, LTD. (JP) | 2011-10-20 | — | — | US | disclosed |
| WO-2010083957-A1 | POLYURETHANE SEALING COMPOUNDS | BAYER MATERIALSCIENCE AG (DE) | 2010-07-29 | — | — | WO | disclosed |
| WO-2010083958-A1 | POLYURETHANE CASTING COMPOUNDS | BAYER MATERIALSCIENCE AG (DE) | 2010-07-29 | — | — | WO | disclosed |