⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1258125 | 0.75 | — | — | |
| SCHEMBL1402864 | 0.73 | SLC6A12 (0.30) | — | |
| SCHEMBL15061640 | 0.72 | — | — | |
| SCHEMBL15061657 | 0.68 | FAAH (0.32) | — | |
| SCHEMBL9442144 | 0.67 | — | — | |
| SCHEMBL1402377 | 0.67 | — | — | |
| SCHEMBL7446365 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL7452545 | 0.64 | ALOX5 (0.35) | — | |
| SCHEMBL2733548 | 0.64 | — | — | |
| SCHEMBL18205682 | 0.64 | — | — |
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-2292597-B1 | METAL COMPOUND, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN, METHOD FOR PRODUCING THE RESIN AND USE OF THE RESIN | MITSUI CHEMICALS INC (JP) | 2015-03-04 | — | — | EP | disclosed |
| US-8697889-B2 | Metal compound, polymerizable composition containing the same, resin, method for producing the resin, and use of the resin | MITSUI CHEMICALS, INC. (JP) | 2014-04-15 | — | — | US | disclosed |
| US-20110136977-A1 | METAL COMPOUND, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN, METHOD FOR PRODUCING THE RESIN, AND USE OF THE RESIN | MITSUI CHEMICALS, INC. (JP) | 2011-06-09 | — | — | US | disclosed |
| EP-2292597-A1 | METAL COMPOUND, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN, METHOD FOR PRODUCING THE RESIN AND USE OF THE RESIN | Mitsui Chemicals, Inc. (JP) | 2011-03-09 | — | — | EP | disclosed |