⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6856452 | 0.92 | — | — | |
| SCHEMBL24982415 | 0.92 | — | — | |
| SCHEMBL11050201 | 0.89 | — | — | |
| SCHEMBL13893235 | 0.87 | — | — | |
| SCHEMBL12180848 | 0.83 | — | — | |
| SCHEMBL9911670 | 0.82 | — | — | |
| SCHEMBL16521076 | 0.80 | GABRR1 (0.30) | — | |
| SCHEMBL12441994 | 0.80 | — | — | |
| SCHEMBL4402506 | 0.80 | — | — | |
| SCHEMBL12180847 | 0.80 | — | — |
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-2461214-B1 | Resist underlayer film composition and patterning process using the same | SHINETSU CHEMICAL CO (JP) | 2013-08-28 | — | — | EP | disclosed |