⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24761752 | 0.90 | FUCA1 (0.31) | — | |
| SCHEMBL26607925 | 0.90 | FUCA1 (0.31) | — | |
| SCHEMBL19000361 | 0.87 | FUCA1 (0.32) | — | |
| SCHEMBL11265925 | 0.82 | — | — | |
| SCHEMBL11261311 | 0.78 | — | — | |
| SCHEMBL24168463 | 0.78 | — | — | |
| SCHEMBL11050196 | 0.75 | FUCA1 (0.40) | — | |
| SCHEMBL14706491 | 0.73 | — | — | |
| SCHEMBL910778 | 0.73 | — | — | |
| SCHEMBL7074482 | 0.73 | — | — |
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-2022004856-A1 | OPTICAL FILM | 住友化学株式会社 | 2022-01-06 | — | — | WO | disclosed |