⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1535099 | 0.90 | CHRM2 (0.30) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL1171510 | 0.80 | CHRM4 (0.34) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL1171508 | 0.80 | ACHE (0.33) | — | |
| SCHEMBL21082713 | 0.79 | CHRM4 (0.33) | — | |
| SCHEMBL29849873 | 0.78 | BBOX1 (0.32) | — | |
| SCHEMBL231898 | 0.78 | BBOX1 (0.33) | — | |
| SCHEMBL272775 | 0.73 | CHRM1 (0.36) | — | |
| SCHEMBL29395688 | 0.73 | — | — | |
| Sulfuric Acid SCHEMBL15361643 | 0.72 | BBOX1 (0.35) | — | |
| SCHEMBL29290535 | 0.72 | BBOX1 (0.35) | — |
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-2023190078-A1 | ADHESIVE SHEET FOR OPTICAL APPLICATIONS | 日東電工株式会社 | 2023-10-05 | — | — | WO | disclosed |