⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6931472 | 0.79 | GABRR1 (0.33) | — | |
| SCHEMBL7198148 | 0.73 | — | — | |
| SCHEMBL493694 | 0.71 | — | — | |
| SCHEMBL6745568 | 0.71 | — | — | |
| SCHEMBL126992 | 0.69 | — | — | |
| SCHEMBL2646177 | 0.69 | — | — | |
| SCHEMBL7198185 | 0.69 | — | — | |
| SCHEMBL11175028 | 0.69 | — | — | |
| SCHEMBL8061372 | 0.67 | TDP1 (0.50) | — | |
| SCHEMBL9419780 | 0.67 | — | — |
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-20040224251-A1 | Positive resist composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-11-11 | — | — | US | disclosed |