⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29612605 | 0.81 | — | — | |
| SCHEMBL9079161 | 0.80 | — | — | |
| SCHEMBL974598 | 0.77 | — | — | |
| SCHEMBL28194228 | 0.77 | — | — | |
| SCHEMBL9988107 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL14759829 | 0.75 | ALDH1A1 (0.32) | — | |
| Methane SCHEMBL18167766 | 0.75 | — | — | |
| SCHEMBL237062 | 0.75 | — | — | |
| SCHEMBL5336286 | 0.72 | — | — | |
| SCHEMBL5567653 | 0.72 | — | — |
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-20100239837-A1 | OPTICAL FILM, PROCESS FOR PRODUCING THE OPTICAL FILM, POLARIZING PLATE, AND DISPLAY DEVICE | KONICA MINOLTA OPTO, INC. (JP) | 2010-09-23 | — | — | US | disclosed |