⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL434024 | 0.88 | KDM4E (0.34) | — | |
| SCHEMBL4319544 | 0.85 | — | — | |
| SCHEMBL436101 | 0.84 | IDO1 (0.38) | — | |
| SCHEMBL8131456 | 0.82 | BCAT1 (0.36) | — | |
| SCHEMBL693886 | 0.81 | MEN1 (0.35) | — | |
| SCHEMBL150097 | 0.81 | PTGS2 (0.35) | — | |
| SCHEMBL7822011 | 0.81 | CYP2A6 (0.39) | — | |
| SCHEMBL28313472 | 0.81 | ALDH1A1 (0.50) | — | |
| SCHEMBL433088 | 0.81 | KMO (0.36) | — | |
| SCHEMBL8129047 | 0.81 | ACHE (0.41) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2930223-B1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC CORP (JP) | 2017-05-31 | — | — | EP | disclosed |
| US-9499745-B2 | Liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2016-11-22 | — | — | US | disclosed |
| US-20150299573-A1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC PETROCHEMICAL CORPORATION (JP) | 2015-10-22 | — | — | US | disclosed |
| EP-2930223-A1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC Corporation (JP) | 2015-10-14 | — | — | EP | disclosed |
| US-20100308266-A1 | Liquid Crystal Composition and Liquid Crystal Display Device | CHISSO CORPORATION (JP) | 2010-12-09 | — | — | US | disclosed |