⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL176352 | 0.94 | — | — | |
| Benzene SCHEMBL28090775 | 0.66 | GRIK1 (0.35) | — | |
| SCHEMBL465616 | 0.65 | — | — | |
| SCHEMBL1584322 | 0.65 | — | — | |
| Benzene SCHEMBL27579016 | 0.63 | LDHA (0.31) | — | |
| SCHEMBL4941929 | 0.63 | — | — | |
| SCHEMBL8981852 | 0.63 | — | — | |
| Ethylene SCHEMBL2488792 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL8012629 | 0.63 | — | — | |
| SCHEMBL9577988 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2910592-B1 | POLYMERIZABLE COMPOSITION, AND CURED ARTICLE | MITSUBISHI GAS CHEMICAL CO (JP) | 2018-09-05 | — | — | EP | disclosed |
| US-9376603-B2 | Polymerizable composition, and cured article | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2016-06-28 | — | — | US | disclosed |
| US-20150252234-A1 | POLYMERIZABLE COMPOSITION, AND CURED ARTICLE | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2015-09-10 | — | — | US | disclosed |
| EP-2910592-A1 | POLYMERIZABLE COMPOSITION, AND CURED ARTICLE | Mitsubishi Gas Chemical Company, Inc. (JP) | 2015-08-26 | — | — | EP | disclosed |