⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18251985 | 0.91 | HCRTR2 (0.31) | — | |
| SCHEMBL18251995 | 0.88 | SPHK1 (0.31) | — | |
| SCHEMBL12623503 | 0.87 | SPHK1 (0.44) | — | |
| SCHEMBL18251999 | 0.87 | — | — | |
| SCHEMBL18251987 | 0.85 | SPHK1 (0.34) | — | |
| SCHEMBL12624632 | 0.85 | RARB (0.40) | — | |
| SCHEMBL12623470 | 0.84 | SPHK1 (0.35) | — | |
| SCHEMBL18252104 | 0.83 | — | — | |
| SCHEMBL18032168 | 0.83 | SPHK1 (0.38) | — | |
| SCHEMBL18251984 | 0.83 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9777219-B2 | Liquid crystal compound having tetracycle, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2017-10-03 | — | — | US | disclosed |
| US-9777219-B2 | Liquid crystal compound having tetracycle, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2017-10-03 | — | — | US | disclosed |
| US-20160340584-A1 | LIQUID CRYSTAL COMPOUND HAVING TETRACYCLE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2016-11-24 | — | — | US | disclosed |
| US-20160340584-A1 | LIQUID CRYSTAL COMPOUND HAVING TETRACYCLE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2016-11-24 | — | — | US | disclosed |