⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18123019 | 0.90 | — | — | |
| SCHEMBL23552638 | 0.86 | CDC25B (0.37) | — | |
| SCHEMBL23552879 | 0.86 | MEN1 (0.30) | — | |
| SCHEMBL23552870 | 0.84 | PKM (0.37) | — | |
| SCHEMBL23552648 | 0.83 | NPC1 (0.32) | — | |
| SCHEMBL18123034 | 0.81 | — | — | |
| SCHEMBL18123004 | 0.80 | CNR2 (0.41) | — | |
| SCHEMBL23552876 | 0.78 | KMT2A (0.33) | — | |
| SCHEMBL18933437 | 0.78 | NPC1 (0.34) | — | |
| SCHEMBL17877629 | 0.78 | MAP2 (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 |
|---|---|---|---|---|---|---|---|
| US-20210191264-A1 | NEGATIVE PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, AND ORGANIC EL DISPLAY AND MANUFACTURING METHOD THEREFOR | TORAY INDUSTRIES, INC. (JP) | 2021-06-24 | — | — | US | disclosed |