⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8945645 | 0.96 | RARB (0.30) | — | |
| SCHEMBL8945708 | 0.95 | RARB (0.32) | — | |
| SCHEMBL8945653 | 0.95 | RARB (0.32) | — | |
| SCHEMBL8945700 | 0.95 | RARB (0.32) | — | |
| SCHEMBL8945688 | 0.95 | RARB (0.32) | — | |
| SCHEMBL8945648 | 0.95 | RARB (0.32) | — | |
| SCHEMBL8945641 | 0.94 | — | — | |
| SCHEMBL18718441 | 0.93 | CTSL (0.33) | — | |
| SCHEMBL18719250 | 0.93 | — | — | |
| SCHEMBL8947397 | 0.91 | — | — |
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-9909064-B2 | Compound having tetrahydropyran ring, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2018-03-06 | — | — | US | disclosed |
| US-9909064-B2 | Compound having tetrahydropyran ring, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2018-03-06 | — | — | US | disclosed |
| US-20170101582-A1 | COMPOUND HAVING TETRAHYDROPYRAN RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2017-04-13 | — | — | US | disclosed |
| US-20170101582-A1 | COMPOUND HAVING TETRAHYDROPYRAN RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2017-04-13 | — | — | US | disclosed |