⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20887806 | 0.86 | HCAR3 (0.32) | — | |
| SCHEMBL25960360 | 0.83 | ELANE (0.30) | — | |
| SCHEMBL20887807 | 0.79 | LMNA (0.41) | — | |
| SCHEMBL25960367 | 0.76 | — | — | |
| SCHEMBL20887809 | 0.72 | ALDH1A1 (0.32) | — | |
| SCHEMBL25960369 | 0.72 | PTGS2 (0.30) | — | |
| SCHEMBL20887805 | 0.71 | LMNA (0.45) | — | |
| SCHEMBL10311814 | 0.70 | ALDH1A1 (0.43) | — | |
| SCHEMBL24188820 | 0.69 | HCAR2 (0.34) | — | |
| SCHEMBL25963929 | 0.69 | HCAR3 (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-2023145535-A1 | RESIST COMPOSITION, RESIST PATTERN FORMATION METHOD, AND COMPOUND | 東京応化工業株式会社 | 2023-08-03 | — | — | WO | disclosed |