⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13628686 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL13628691 | 0.78 | ALDH1A1 (0.40) | — | |
| SCHEMBL14347061 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL13628689 | 0.55 | TSHR (0.39) | — | |
| SCHEMBL13895393 | 0.54 | PKM (0.48) | — | |
| SCHEMBL17924783 | 0.53 | THRB (0.48) | — | |
| SCHEMBL17924782 | 0.53 | THRB (0.48) | — | |
| SCHEMBL14388437 | 0.53 | PKM (0.47) | — | |
| SCHEMBL13628685 | 0.52 | — | — | |
| SCHEMBL3846370 | 0.52 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7612155-B2 | Film forming composition, insulating film formed by use of the composition, and electronic device | FUJIFILM CORPORATION (JP) | 2009-11-03 | — | — | US | disclosed |