⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9613601 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1971667-B1 | LIQUID CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2011-04-20 | — | — | EP | disclosed |
| EP-2295520-A2 | Liquid crystalline medium | Merck Patent GmbH (DE) | 2011-03-16 | — | — | EP | disclosed |
| WO-2009080261-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2009-07-02 | — | — | WO | disclosed |
| EP-1746079-B1 | Fluorinated biphenyl compounds for use in liquid crystal compositions | MERCK PATENT GMBH (DE) | 2008-03-26 | — | — | EP | disclosed |
| EP-1436358-B1 | LIQUID CRYSTAL COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-12-19 | — | — | EP | disclosed |
| EP-1746079-A2 | Fluorinated biphenyl compounds for use in liquid crystal compositions | Merck Patent GmbH (DE) | 2007-01-24 | — | — | EP | disclosed |
| EP-1310474-B1 | Fluorinated biphenyl compounds and their use in liquid crystal compositions | MERCK PATENT GMBH (DE) | 2007-01-03 | — | — | EP | disclosed |