⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17469230 | 0.88 | — | — | |
| SCHEMBL18649140 | 0.86 | — | — | |
| SCHEMBL18649078 | 0.71 | — | — | |
| SCHEMBL17469348 | 0.71 | — | — | |
| SCHEMBL14414564 | 0.67 | — | — | |
| SCHEMBL19847434 | 0.65 | — | — | |
| SCHEMBL12794448 | 0.60 | EPHX1 (0.35) | — | |
| SCHEMBL28206894 | 0.59 | KMT2A (0.34) | — | |
| SCHEMBL12966871 | 0.58 | — | — | |
| SCHEMBL21900420 | 0.55 | — | — |
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-9598639-B2 | Liquid-crystal compound, liquid-crystal composition and liquid-crystal display device | DAXIN MATERIALS CORPORATION (TW) | 2017-03-21 | — | — | US | disclosed |
| US-20160024384-A1 | LIQUID-CRYSTAL COMPOUND, LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY DEVICE | DAXIN MATERIALS CORPORATION (TW) | 2016-01-28 | — | — | US | disclosed |