⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27492874 | 0.93 | — | — | |
| SCHEMBL2008 | 0.93 | — | — | |
| SCHEMBL28671035 | 0.86 | — | — | |
| SCHEMBL29612004 | 0.86 | — | — | |
| SCHEMBL27401055 | 0.86 | — | — | |
| Fluoride SCHEMBL28030117 | 0.86 | — | — | |
| SCHEMBL28863489 | 0.86 | — | — | |
| SCHEMBL28513479 | 0.86 | — | — | |
| Water SCHEMBL27446863 | 0.86 | — | — | |
| Methane SCHEMBL28272667 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103849406-B | Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display element, phase difference film, manufacturing method for the phase difference film, polymer, and compound | JSR株式会社 | 2017-03-22 | — | — | CN | disclosed |
| CN-103547553-B | Make phenols and 2, 2-Oxydiphenol class method for hydroxylation | 罗地亚经营管理公司 | 2016-06-29 | — | — | CN | disclosed |