⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8966439 | 1.00 | — | — | |
| SCHEMBL8966427 | 1.00 | — | — | |
| SCHEMBL8966431 | 1.00 | — | — | |
| SCHEMBL8966460 | 1.00 | — | — | |
| SCHEMBL8966410 | 0.99 | — | — | |
| SCHEMBL8966425 | 0.97 | — | — | |
| SCHEMBL8964783 | 0.94 | RARB (0.31) | — | |
| SCHEMBL8964801 | 0.94 | RARB (0.31) | — | |
| SCHEMBL8964802 | 0.94 | RARB (0.31) | — | |
| SCHEMBL8964812 | 0.94 | RARB (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8187494-B2 | Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2012-05-29 | — | — | US | disclosed |
| US-20100309402-A1 | FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE | CHISSO CORPORATION (JP) | 2010-12-09 | — | — | US | disclosed |