⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13758098 | 0.88 | — | — | |
| SCHEMBL10033541 | 0.85 | HMGCR (0.31) | — | |
| SCHEMBL13823373 | 0.79 | — | — | |
| SCHEMBL21505907 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL24687529 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL304110 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL10180043 | 0.74 | ATM (0.30) | — | |
| SCHEMBL19038481 | 0.72 | ATM (0.41) | — | |
| SCHEMBL23974099 | 0.72 | — | — | |
| SCHEMBL21164018 | 0.72 | DPP4 (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-2021039407-A1 | ACTIVE-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, PATTERN FORMATION METHOD, AND ELECTRONIC DEVICE MANUFACTURING METHOD | 富士フイルム株式会社 | 2021-03-04 | — | — | WO | disclosed |