⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8218767 | 1.00 | — | — | |
| SCHEMBL8220280 | 0.98 | — | — | |
| SCHEMBL8217378 | 0.92 | — | — | |
| SCHEMBL7744145 | 0.86 | LMNA (0.38) | — | |
| SCHEMBL8218444 | 0.85 | TSHR (0.35) | — | |
| SCHEMBL8216636 | 0.85 | TSHR (0.35) | — | |
| SCHEMBL8215882 | 0.83 | — | — | |
| SCHEMBL8220272 | 0.82 | TSHR (0.37) | — | |
| SCHEMBL8208557 | 0.82 | — | — | |
| SCHEMBL8222274 | 0.82 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6143198-A | SUITABLE FOR USE AS ELECTRO-OPTICAL DISPLAY MATERIALS; LIQUID CRYSTALLINE COMPOUND HAVING A LARGE ELASTIC CONSTANT RATIO, EXCELLENT COMPATIBILITY WITH OTHER LIQUID CRYSTALLINE COMPOUND, AND LOW TEMPERATURE CHEMICAL STABILITY | CHISSO CORPORATION (JP) | 2000-11-07 | — | — | US | disclosed |
| EP-0828700-A1 | LIQUID CRYSTALLINE COMPOUNDS HAVING EXO-METHYLENE SITE AND LIQUID CRYSTAL COMPOSITIONS COMPRISING THE SAME | CHISSO CORPORATION (JP) | 1998-03-18 | — | — | EP | disclosed |
| WO-1996037451-A1 | LIQUID CRYSTALLINE COMPOUNDS HAVING EXO-METHYLENE SITE AND LIQUID CRYSTAL COMPOSITIONS COMPRISING THE SAME | CHISSO CORPORATION (JP) | 1996-11-28 | — | — | WO | disclosed |