⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24604567 | 0.81 | MAPK1 (0.36) | — | |
| SCHEMBL21533348 | 0.80 | ALDH1A1 (0.31) | — | |
| SCHEMBL20343373 | 0.79 | — | — | |
| SCHEMBL24639073 | 0.78 | — | — | |
| SCHEMBL24262515 | 0.75 | MEN1 (0.41) | — | |
| SCHEMBL24157932 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL26842778 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL23463261 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL19523057 | 0.74 | NAALAD2 (0.30) | — | |
| SCHEMBL24351766 | 0.74 | TSHR (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023136364-A1 | CYTOKINE-ENCAPSULATING POLYMERIC MICELLE | 国立大学法人東京大学 | 2023-07-20 | — | — | WO | disclosed |