⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25854312 | 0.94 | ELANE (0.33) | — | |
| SCHEMBL25859851 | 0.89 | ELANE (0.30) | — | |
| SCHEMBL25853710 | 0.88 | — | — | |
| SCHEMBL25856221 | 0.87 | ELANE (0.34) | — | |
| SCHEMBL25853367 | 0.87 | ELANE (0.36) | — | |
| SCHEMBL25854078 | 0.87 | — | — | |
| SCHEMBL25853455 | 0.86 | ELANE (0.31) | — | |
| SCHEMBL25854953 | 0.86 | ELANE (0.34) | — | |
| SCHEMBL25853529 | 0.83 | TYMS (0.32) | — | |
| SCHEMBL25859496 | 0.82 | ELANE (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 |
|---|---|---|---|---|---|---|---|
| WO-2023134598-A1 | POLYMERISABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE | 烟台显华科技集团股份有限公司 | 2023-07-20 | — | — | WO | disclosed |
| WO-2023134596-A1 | NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT | 烟台显华科技集团股份有限公司 | 2023-07-20 | — | — | WO | disclosed |