⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1025002 | 0.79 | — | — | |
| SCHEMBL1023405 | 0.68 | — | — | |
| SCHEMBL1025704 | 0.59 | — | — | |
| SCHEMBL1023921 | 0.58 | — | — | |
| SCHEMBL6142297 | 0.51 | — | — | |
| SCHEMBL6142405 | 0.50 | — | — | |
| SCHEMBL1024564 | 0.49 | — | — | |
| SCHEMBL3253505 | 0.49 | — | — | |
| SCHEMBL6434026 | 0.46 | — | — | |
| SCHEMBL1025818 | 0.45 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |