⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11312167 | 0.81 | — | — | |
| SCHEMBL9803652 | 0.81 | — | — | |
| SCHEMBL11584789 | 0.81 | — | — | |
| SCHEMBL1602822 | 0.81 | — | — | |
| SCHEMBL4374322 | 0.81 | — | — | |
| SCHEMBL1404426 | 0.81 | — | — | |
| SCHEMBL28145832 | 0.81 | — | — | |
| SCHEMBL16470051 | 0.79 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL21844856 | 0.79 | — | — | |
| SCHEMBL3467973 | 0.79 | SMN1; SMN2 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107849330-A | Polymer composition, aligning agent for liquid crystal, liquid crystal orientation film, the substrate with the liquid crystal orientation film and the liquid crystal with the liquid crystal orientation film represent element | 日产化学工业株式会社 | 2018-03-27 | — | — | CN | disclosed |