⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17827799 | 0.90 | CES2 (0.31) | — | |
| SCHEMBL8767030 | 0.84 | ALDH1A1 (0.33) | — | |
| SCHEMBL19159774 | 0.83 | NPC1 (0.34) | — | |
| SCHEMBL12997531 | 0.83 | CES2 (0.35) | — | |
| SCHEMBL19415924 | 0.83 | CYP3A4 (0.33) | — | |
| SCHEMBL13557300 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL19624341 | 0.81 | HTR2A (0.37) | — | |
| SCHEMBL13345607 | 0.81 | — | — | |
| SCHEMBL12228209 | 0.81 | ESR2 (0.42) | — | |
| SCHEMBL9763483 | 0.81 | ESR2 (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-3434750-B1 | LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY ELEMENT | JNC CORP (JP) | 2020-11-18 | — | — | EP | disclosed |
| EP-3061802-B1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORP (JP) | 2019-09-25 | — | — | EP | disclosed |
| EP-3018186-B1 | LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC CORP (JP) | 2019-07-24 | — | — | EP | disclosed |
| EP-2801602-B1 | NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME | DAINIPPON INK & CHEMICALS (JP) | 2017-10-04 | — | — | EP | disclosed |
| EP-2806010-B1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME | DAINIPPON INK & CHEMICALS (JP) | 2017-07-26 | — | — | EP | disclosed |