⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5849518 | 0.78 | — | — | |
| SCHEMBL7687632 | 0.59 | — | — | |
| SCHEMBL8734753 | 0.56 | — | — | |
| SCHEMBL11202866 | 0.55 | — | — | |
| SCHEMBL4299061 | 0.54 | — | — | |
| SCHEMBL4945349 | 0.54 | — | — | |
| SCHEMBL17460053 | 0.54 | — | — | |
| SCHEMBL14931426 | 0.54 | — | — | |
| SCHEMBL8730174 | 0.52 | — | — | |
| SCHEMBL1445443 | 0.51 | — | — |
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-5725796-A | Liquid-crystal display | MERCK PATENT GESELLSCHAFT MET BESCHRANKTER HAFTUNG (DE) | 1998-03-10 | — | — | US | disclosed |