⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28139835 | 0.91 | CHRNA7 (0.34) | — | |
| SCHEMBL29229728 | 0.88 | GAA (0.34) | — | |
| SCHEMBL29824026 | 0.84 | L3MBTL1 (0.34) | — | |
| SCHEMBL27500452 | 0.79 | ALDH1A1 (0.41) | — | |
| SCHEMBL28311090 | 0.77 | DRD2 (0.38) | — | |
| Hydrochloric Acid SCHEMBL30758819 | 0.77 | DYRK1A (0.35) | — | |
| SCHEMBL28139837 | 0.74 | GRM2 (0.42) | — | |
| Iodide SCHEMBL28880225 | 0.71 | — | — | |
| SCHEMBL1706040 | 0.71 | — | — | |
| SCHEMBL8173104 | 0.71 | — | — |
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-118591764-A | Optical drive electrochromic display | 鲜猿股份公司 | 2024-09-03 | — | — | CN | disclosed |