⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15436 | 0.86 | KDM4E (0.32) | — | |
| SCHEMBL30055448 | 0.84 | LMNA (0.32) | — | |
| SCHEMBL949290 | 0.82 | — | — | |
| SCHEMBL14754909 | 0.82 | PPM1B (0.35) | — | |
| SCHEMBL22701849 | 0.82 | PPM1B (0.35) | — | |
| SCHEMBL23862867 | 0.82 | PPM1B (0.35) | — | |
| SCHEMBL16274032 | 0.82 | PPM1B (0.35) | — | |
| SCHEMBL22058684 | 0.82 | PPM1B (0.35) | — | |
| SCHEMBL23615814 | 0.82 | PPM1B (0.35) | — | |
| SCHEMBL14366763 | 0.82 | PPM1B (0.35) | — |
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-110121537-B | Coating composition capable of achieving low curling and film prepared therefrom | 株式会社东进世美肯 | 2022-12-23 | — | — | CN | disclosed |