⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19999442 | 0.94 | — | — | |
| SCHEMBL19999606 | 0.87 | RARB (0.33) | — | |
| SCHEMBL20004801 | 0.86 | — | — | |
| SCHEMBL20004799 | 0.86 | — | — | |
| SCHEMBL19999640 | 0.85 | — | — | |
| SCHEMBL18746964 | 0.85 | RARB (0.33) | — | |
| SCHEMBL18747925 | 0.85 | RARB (0.33) | — | |
| SCHEMBL19999539 | 0.84 | — | — | |
| SCHEMBL20006852 | 0.84 | ALOX5AP (0.31) | — | |
| SCHEMBL19999567 | 0.84 | RARB (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180086979-A1 | LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2018-03-29 | — | — | US | disclosed |