⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18434941 | 1.00 | — | — | |
| SCHEMBL9650398 | 0.73 | GBA1 (0.33) | — | |
| SCHEMBL9650404 | 0.73 | GBA1 (0.33) | — | |
| SCHEMBL4892113 | 0.71 | CYP2C9 (0.48) | — | |
| SCHEMBL15923504 | 0.70 | GLB1 (0.31) | — | |
| SCHEMBL24506594 | 0.68 | — | — | |
| SCHEMBL1879862 | 0.68 | — | — | |
| SCHEMBL16893285 | 0.67 | — | — | |
| SCHEMBL9880663 | 0.65 | — | — | |
| SCHEMBL17875143 | 0.65 | GLB1 (0.37) | — |
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-2657766-B1 | Patterning process | SHINETSU CHEMICAL CO (JP) | 2018-02-28 | — | — | EP | disclosed |