⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21864874 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL21864875 | 0.86 | — | — | |
| SCHEMBL21864887 | 0.85 | — | — | |
| SCHEMBL21864882 | 0.78 | — | — | |
| SCHEMBL21864900 | 0.76 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL21864886 | 0.71 | THRB (0.38) | — | |
| SCHEMBL21864957 | 0.71 | — | — | |
| SCHEMBL21864878 | 0.70 | — | — | |
| SCHEMBL21864899 | 0.63 | — | — | |
| SCHEMBL13338767 | 0.62 | — | — |
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-20200089116-A1 | Fluorine-Containing Monomer, Fluorine-Containing Polymer, Pattern Forming Composition Using Same, and Pattern Forming Method of Same | CENTRAL GLASS COMPANY, LIMITED (JP) | 2020-03-19 | — | — | US | disclosed |