⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3951963 | 0.86 | FDPS (0.31) | — | |
| SCHEMBL10704442 | 0.82 | — | — | |
| SCHEMBL28949342 | 0.79 | — | — | |
| SCHEMBL29164872 | 0.69 | — | — | |
| SCHEMBL9195038 | 0.69 | — | — | |
| SCHEMBL3400691 | 0.66 | — | — | |
| SCHEMBL14721342 | 0.63 | TSHR (0.30) | — | |
| SCHEMBL28411497 | 0.63 | — | — | |
| SCHEMBL30762330 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL30762328 | 0.63 | ALDH1A1 (0.33) | — |
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-112552682-A | Polyimide precursor solution, method for producing polyimide film, and method for producing separator for lithium ion secondary battery | 富士施乐株式会社 | 2021-03-26 | — | — | CN | disclosed |