⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21800 | 0.88 | — | — | |
| SCHEMBL10961485 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL10962253 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL97813 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL688499 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL5718534 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL10959938 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL688308 | 0.82 | — | — | |
| SCHEMBL2369151 | 0.82 | TSHR (0.67) | — | |
| SCHEMBL977941 | 0.82 | TSHR (0.67) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8575293-B2 | Resin composition for optical material and optical material using the same | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2013-11-05 | — | — | US | disclosed |
| EP-2058346-B1 | RESIN COMPOSITION FOR OPTICAL MATERIAL AND OPTICAL MATERIAL USING THE SAME | MITSUBISHI GAS CHEMICAL CO (JP) | 2012-03-07 | — | — | EP | disclosed |
| US-20100004421-A1 | RESIN COMPOSITION FOR OPTICAL MATERIAL AND OPTICAL MATERIAL USING THE SAME | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2010-01-07 | — | — | US | disclosed |
| EP-2058346-A1 | RESIN COMPOSITION FOR OPTICAL MATERIAL AND OPTICAL MATERIAL USING THE SAME | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2009-05-13 | — | — | EP | disclosed |