⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12657234 | 0.93 | — | — | |
| SCHEMBL12657233 | 0.90 | — | — | |
| SCHEMBL20195864 | 0.85 | — | — | |
| SCHEMBL14393321 | 0.84 | — | — | |
| SCHEMBL14640142 | 0.82 | — | — | |
| SCHEMBL14410788 | 0.82 | — | — | |
| SCHEMBL14640164 | 0.82 | — | — | |
| SCHEMBL13356903 | 0.81 | — | — | |
| SCHEMBL13673333 | 0.79 | — | — | |
| SCHEMBL13239351 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3331965-B1 | LIQUID CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2022-01-05 | — | — | EP | disclosed |