⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2058532 | 0.85 | — | — | |
| SCHEMBL301860 | 0.80 | — | — | |
| SCHEMBL49561 | 0.80 | — | — | |
| SCHEMBL23877903 | 0.76 | — | — | |
| Fluoride SCHEMBL27447853 | 0.76 | — | — | |
| SCHEMBL19667830 | 0.76 | — | — | |
| SCHEMBL11654982 | 0.72 | ALDH1A1 (0.42) | — | |
| Alcohol SCHEMBL28401219 | 0.69 | — | — | |
| SCHEMBL25205913 | 0.67 | — | — | |
| SCHEMBL25205866 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20060222847-A1 | PHOTOCATALYST HARD COAT FILM | LINTEC CORPORATION (JP) | 2006-10-05 | — | — | US | disclosed |