⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21507789 | 1.00 | — | — | |
| SCHEMBL10020912 | 1.00 | — | — | |
| SCHEMBL12352229 | 0.98 | — | — | |
| SCHEMBL10022781 | 0.98 | — | — | |
| SCHEMBL5966685 | 0.98 | — | — | |
| SCHEMBL13505142 | 0.96 | — | — | |
| SCHEMBL9926472 | 0.91 | — | — | |
| SCHEMBL9972446 | 0.91 | — | — | |
| SCHEMBL13871748 | 0.89 | — | — | |
| SCHEMBL12841427 | 0.89 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2937401-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2017-04-05 | — | — | EP | disclosed |
| EP-3048159-A1 | LIQUID CRYSTAL MEDIUM | Merck Patent GmbH (DE) | 2016-07-27 | — | — | EP | disclosed |
| EP-2980062-A2 | POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS | Merck Patent GmbH (DE) | 2016-02-03 | — | — | EP | disclosed |
| WO-2014090362-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2014-06-19 | — | — | WO | disclosed |
| WO-2012163478-A1 | POLYMERIZABLE COMPOUNDS AND THEIR USE IN LIQUID CRYSTAL MEDIA AND LIQUID CRYSTAL DISPLAYS | MERCK PATENT GMBH (DE) | 2012-12-06 | — | — | WO | disclosed |
| EP-2471892-A2 | Liquid crystal display | Merck Patent GmbH (DE) | 2012-07-04 | — | — | EP | disclosed |
| WO-2011160765-A1 | POLYMERIZIBLE COMPOUNDS AND USE THEREOF IN LIQUID CRYSTAL DISPLAYS | MERCK PATENT GMBH (DE) | 2011-12-29 | — | — | WO | disclosed |
| WO-2011160764-A1 | POLYMERIZABLE COMPOUNDS AND USE THEREOF IN LIQUID CRYSTAL DISPLAYS | MERCK PATENT GMBH (DE) | 2011-12-29 | — | — | WO | disclosed |
| WO-2010049044-A1 | LIQUID CRYSTAL DISPLAY | MERCK PATENT GMBH (DE) | 2010-05-06 | — | — | WO | disclosed |