⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7902006 | 1.00 | — | — | |
| SCHEMBL7902009 | 1.00 | — | — | |
| SCHEMBL7902004 | 1.00 | — | — | |
| SCHEMBL7915693 | 0.86 | — | — | |
| SCHEMBL7915686 | 0.86 | — | — | |
| SCHEMBL7915689 | 0.86 | — | — | |
| SCHEMBL7915695 | 0.86 | — | — | |
| SCHEMBL7901855 | 0.85 | — | — | |
| SCHEMBL7901841 | 0.85 | — | — | |
| SCHEMBL7901852 | 0.85 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0750028-B1 | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | CHISSO CORP (JP) | 2001-04-18 | — | — | EP | disclosed |
| US-5776367-A | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | CHISSO CORPORATION (JP) | 1998-07-07 | — | — | US | disclosed |
| EP-0750028-A2 | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | Chisso Corporation (JP) | 1996-12-27 | — | — | EP | disclosed |