⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1408224 | 0.82 | NR1I2 (0.33) | — | |
| SCHEMBL1408673 | 0.80 | NR1I2 (0.32) | — | |
| SCHEMBL6437607 | 0.75 | NR1I2 (0.32) | — | |
| SCHEMBL1408658 | 0.73 | NR1I2 (0.38) | — | |
| SCHEMBL331317 | 0.71 | — | — | |
| SCHEMBL1408724 | 0.70 | NR1I2 (0.36) | — | |
| SCHEMBL4135462 | 0.67 | — | — | |
| SCHEMBL21624975 | 0.63 | NR1I2 (0.31) | — | |
| SCHEMBL29098934 | 0.60 | — | — | |
| SCHEMBL29539835 | 0.60 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3345954-B1 | POLYROTAXANE, PRODUCTION METHOD THEREFOR, AND OPTICAL COMPOSITION CONTAINING SAID POLYROTAXANE | TOKUYAMA CORP (JP) | 2023-07-05 | — | — | EP | disclosed |
| US-11578174-B2 | Polyrotaxane, production method therefor, and optical composition containing said polyrotaxane | TOKUYAMA CORPORATION (JP) | 2023-02-14 | — | — | US | disclosed |
| EP-3330751-B1 | METHOD OF PRODUCING A PHOTOCHROMIC LAMINATE | TOKUYAMA CORP (JP) | 2021-05-26 | — | — | EP | disclosed |
| EP-3269774-B1 | METHOD FOR PRODUCING PHOTOCHROMIC CURED BODY | TOKUYAMA CORP (JP) | 2020-12-09 | — | — | EP | disclosed |
| US-20200071467-A1 | Polyrotaxane, Production Method Therefor, and Optical Composition Containing said Polyrotaxane | TOKUYAMA CORPORATION (JP) | 2020-03-05 | — | — | US | disclosed |
| US-20180312643-A1 | Polyrotaxane, Production Method Therefor, and Optical Composition Containing said Polyrotaxane | TOKUYAMA CORPORATION (JP) | 2018-11-01 | — | — | US | disclosed |
| US-20180244931-A1 | PHOTOCHROMIC COATING COMPOSITION | TOKUYAMA CORPORATION (JP) | 2018-08-30 | — | — | US | disclosed |
| EP-3345954-A1 | POLYROTAXANE, PRODUCTION METHOD THEREFOR, AND OPTICAL COMPOSITION CONTAINING SAID POLYROTAXANE | Tokuyama Corporation (JP) | 2018-07-11 | — | — | EP | disclosed |
| EP-3330751-A1 | PHOTOCHROMIC COATING COMPOSITION | Tokuyama Corporation (JP) | 2018-06-06 | — | — | EP | disclosed |
| US-20180030341-A1 | PROCESS FOR PRODUCING A PHOTOCHROMIC CURED BODY | TOKUYAMA CORPORATION (JP) | 2018-02-01 | — | — | US | disclosed |
| EP-3269774-A1 | METHOD FOR PRODUCING PHOTOCHROMIC CURED BODY | Tokuyama Corporation (JP) | 2018-01-17 | — | — | EP | disclosed |
| EP-1524289-B1 | POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL | MITSUBISHI GAS CHEMICAL CO (JP) | 2009-09-16 | — | — | EP | disclosed |
| US-20070149639-A1 | Polymerizable composition, optical material comprising the composition and method for producing the material | HORIKOSHI HIROSHI | 2007-06-28 | — | — | US | disclosed |
| EP-1524289-A1 | POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2005-04-20 | — | — | EP | disclosed |
| US-20040254258-A1 | Polymerizable composition, optical material comprising the composition and method for producing the material | MITSUBISHI GAS CHEMICAL CO., LTD. (JP) | 2004-12-16 | — | — | US | disclosed |