⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2116132 | 0.78 | — | — | |
| SCHEMBL25011787 | 0.72 | — | — | |
| SCHEMBL2118504 | 0.69 | — | — | |
| SCHEMBL376361 | 0.67 | CYP1A2 (0.31) | — | |
| SCHEMBL4300065 | 0.67 | LMNA (0.36) | — | |
| SCHEMBL6476727 | 0.67 | LMNA (0.36) | — | |
| SCHEMBL17413752 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL8504406 | 0.65 | ELANE (0.31) | — | |
| SCHEMBL25012746 | 0.65 | — | — | |
| SCHEMBL6401815 | 0.64 | PDE4A (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023013697-A1 | MATERIAL FOR METAL PATTERNING, FLUORO COMPOUND, THIN FILM FOR METAL PATTERNING, ORGANIC ELECTROLUMINESCENCE DEVICE, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN | 東ソー株式会社 | 2023-02-09 | — | — | WO | disclosed |