⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12622176 | 0.96 | GRM2 (0.30) | — | |
| SCHEMBL12621886 | 0.93 | ALOX5AP (0.33) | — | |
| SCHEMBL12622236 | 0.92 | GRM2 (0.34) | — | |
| SCHEMBL12622332 | 0.91 | — | — | |
| SCHEMBL12622221 | 0.90 | GRM2 (0.32) | — | |
| SCHEMBL12622330 | 0.89 | GRM2 (0.31) | — | |
| SCHEMBL16325643 | 0.89 | GRM2 (0.34) | — | |
| SCHEMBL12622256 | 0.88 | GRM2 (0.33) | — | |
| SCHEMBL12622301 | 0.88 | CYP11B1 (0.31) | — | |
| SCHEMBL12621984 | 0.88 | GRM2 (0.34) | — |
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-7951432-B2 | Five-ring liquid crystal compound having cyclohexane ring, liquid crystal composition, and liquid crystal display device | CHISSO CORPORATION (JP) | 2011-05-31 | — | — | US | disclosed |
| US-20090302273-A1 | FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CYCLOHEXANE RING, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE | CHISSO CORPORATION (JP) | 2009-12-10 | — | — | US | disclosed |