⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9699966 | 0.91 | EPHX2 (0.33) | — | |
| SCHEMBL9698682 | 0.90 | OPRM1 (0.35) | — | |
| SCHEMBL9699148 | 0.89 | — | — | |
| SCHEMBL9698689 | 0.88 | OPRM1 (0.34) | — | |
| SCHEMBL9697713 | 0.85 | — | — | |
| SCHEMBL9699962 | 0.82 | EPHX2 (0.31) | — | |
| SCHEMBL9698659 | 0.81 | OPRM1 (0.32) | — | |
| SCHEMBL9699183 | 0.79 | FAAH (0.33) | — | |
| SCHEMBL9697613 | 0.79 | ALDH1A1 (0.31) | — | |
| SCHEMBL9697694 | 0.77 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0518636-A1 | Liquid crystal compounds and compositions | SANYO CHEMICAL INDUSTRIES LTD. (JP) | 1992-12-16 | — | — | EP | disclosed |
| EP-0517498-A1 | Liquid crystal compounds and compositions | SANYO CHEMICAL INDUSTRIES LTD. (JP) | 1992-12-09 | — | — | EP | disclosed |
| EP-0500210-A2 | Liquid crystal compounds and compositions | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1992-08-26 | — | — | EP | disclosed |
| EP-0409634-A2 | Liquid crystal compounds and optically active compounds | SANYO CHEMICAL INDUSTRIES LTD. (JP) | 1991-01-23 | — | — | EP | disclosed |