⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2768154 | 0.63 | — | — | |
| SCHEMBL23544296 | 0.58 | — | — | |
| SCHEMBL2900666 | 0.58 | — | — | |
| SCHEMBL1618854 | 0.56 | — | — | |
| SCHEMBL2896155 | 0.56 | — | — | |
| SCHEMBL2773176 | 0.56 | — | — | |
| SCHEMBL23544306 | 0.56 | — | — | |
| SCHEMBL21496031 | 0.56 | — | — | |
| SCHEMBL21496033 | 0.56 | — | — | |
| SCHEMBL17961651 | 0.53 | — | — |
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-2036940-B1 | POLYMERIZABLE COMPOSITION, RESIN USING THE SAME, OPTICAL COMPONENT AND COMPOUND | MITSUI CHEMICALS INC (JP) | 2013-02-27 | — | — | EP | disclosed |
| US-7928247-B2 | Polymerizable composition, resin using the same, optical component and compound | MITSUI CHEMICALS, INC. (JP) | 2011-04-19 | — | — | US | disclosed |
| US-20090192288-A1 | POLYMERIZABLE COMPOSITION, RESIN USING THE SAME, OPTICAL COMPONENT AND COMPOUND | MITSUI CHEMICALS, INC. (JP) | 2009-07-30 | — | — | US | disclosed |
| EP-2036940-A1 | POLYMERIZABLE COMPOSITION, RESIN USING THE SAME, OPTICAL COMPONENT AND COMPOUND | Mitsui Chemicals, Inc. (JP) | 2009-03-18 | — | — | EP | disclosed |