⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12807331 | 1.00 | — | — | |
| SCHEMBL13465029 | 1.00 | — | — | |
| SCHEMBL13464794 | 0.93 | — | — | |
| SCHEMBL13464850 | 0.93 | — | — | |
| SCHEMBL15692428 | 0.91 | — | — | |
| SCHEMBL13992798 | 0.89 | — | — | |
| SCHEMBL12995535 | 0.89 | — | — | |
| SCHEMBL12657300 | 0.89 | — | — | |
| SCHEMBL883562 | 0.89 | — | — | |
| SCHEMBL13464793 | 0.87 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8715527-B2 | Liquid-crystal medium | MERCK PATENT GMBH (DE) | 2014-05-06 | — | — | US | disclosed |
| EP-2457975-A2 | Liquid-crystalline mixtures | Merck Patent GmbH (DE) | 2012-05-30 | — | — | EP | disclosed |
| US-20110042615-A1 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2011-02-24 | — | — | US | disclosed |
| EP-2182041-A2 | Liquid crystal medium comprising 1,2-difluorethene compounds, and liquid crystal display | MERCK PATENT GmbH (DE) | 2010-05-05 | — | — | EP | disclosed |
| EP-1808473-B1 | Liquid crystal medium | MERCK PATENT GMBH (DE) | 2010-02-10 | — | — | EP | disclosed |
| EP-1335014-B1 | Liquid crystalline medium | MERCK PATENT GMBH (DE) | 2010-01-06 | — | — | EP | disclosed |
| EP-1248826-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2009-10-28 | — | — | EP | disclosed |
| EP-1302523-B1 | Liquid crystalline medium | MERCK PATENT GMBH (DE) | 2009-07-15 | — | — | EP | disclosed |
| EP-1756248-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2008-12-03 | — | — | EP | disclosed |
| EP-1565540-B1 | LIQUID CRYSTALLINE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-09-26 | — | — | EP | disclosed |