⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1984439 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL24514886 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL26318598 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL1985873 | 0.69 | — | — | |
| SCHEMBL6343065 | 0.69 | TSHR (0.35) | — | |
| SCHEMBL13395755 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL13395757 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL13395730 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL5931047 | 0.69 | TDP1 (0.35) | — | |
| SCHEMBL77807 | 0.67 | ALDH1A1 (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-9809752-B2 | Liquid crystal display device | DIC CORPORATION (JP) | 2017-11-07 | — | — | US | disclosed |
| US-20160130502-A1 | LIQUID CRYSTAL DISPLAY DEVICE | DIC CORPORATION (JP) | 2016-05-12 | — | — | US | disclosed |