⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18324948 | 0.94 | — | — | |
| SCHEMBL18324941 | 0.94 | PSEN1 (0.30) | — | |
| SCHEMBL18324944 | 0.86 | — | — | |
| SCHEMBL18324918 | 0.84 | — | — | |
| SCHEMBL18324943 | 0.81 | — | — | |
| SCHEMBL16790904 | 0.80 | — | — | |
| SCHEMBL16258130 | 0.79 | — | — | |
| SCHEMBL18855137 | 0.78 | — | — | |
| SCHEMBL13164842 | 0.76 | — | — | |
| SCHEMBL18887736 | 0.76 | — | — |
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-9862886-B2 | Compound, liquid crystal composition including the same, and liquid crystal display device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-01-09 | — | — | US | disclosed |
| US-20160369167-A1 | COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME, AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-12-22 | — | — | US | disclosed |
| US-20160369167-A1 | COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME, AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-12-22 | — | — | US | disclosed |