⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12346003 | 0.93 | — | — | |
| SCHEMBL12346005 | 0.91 | — | — | |
| SCHEMBL26061846 | 0.82 | — | — | |
| SCHEMBL26939611 | 0.79 | ADORA3 (0.36) | — | |
| SCHEMBL12346001 | 0.79 | LIPA (0.35) | — | |
| SCHEMBL12346002 | 0.78 | LIPA (0.34) | — | |
| SCHEMBL24177937 | 0.78 | MAPT (0.31) | — | |
| SCHEMBL26939596 | 0.78 | ADORA3 (0.38) | — | |
| SCHEMBL13446152 | 0.78 | — | — | |
| SCHEMBL682748 | 0.78 | ADORA3 (0.30) | — |
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-2020246143-A1 | RADIATION-SENSITIVE RESIN COMPOSITION, RESIST PATTERN FORMATION METHOD, AND COMPOUND | JSR株式会社 | 2020-12-10 | — | — | WO | disclosed |