⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13579478 | 1.00 | — | — | |
| SCHEMBL13579407 | 1.00 | — | — | |
| SCHEMBL13579462 | 1.00 | — | — | |
| SCHEMBL13579303 | 1.00 | — | — | |
| SCHEMBL13579390 | 1.00 | — | — | |
| SCHEMBL13579502 | 0.95 | — | — | |
| SCHEMBL13579358 | 0.95 | — | — | |
| SCHEMBL13579382 | 0.95 | — | — | |
| SCHEMBL13579296 | 0.95 | — | — | |
| SCHEMBL13579280 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8372306-B2 | Liquid crystal compound having negative dielectric anisotropy, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2013-02-12 | — | — | US | disclosed |
| US-8372306-B2 | Liquid crystal compound having negative dielectric anisotropy, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2013-02-12 | — | — | US | disclosed |
| US-20090324854-A1 | LIQUID CRYSTAL COMPOUND HAVING NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE | CHISSO CORPORATION (JP) | 2009-12-31 | — | — | US | disclosed |
| US-20090324854-A1 | LIQUID CRYSTAL COMPOUND HAVING NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE | CHISSO CORPORATION (JP) | 2009-12-31 | — | — | US | disclosed |