⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18412079 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL8312929 | 0.69 | — | — | |
| SCHEMBL21872607 | 0.65 | — | — | |
| SCHEMBL23653955 | 0.65 | — | — | |
| SCHEMBL8135724 | 0.64 | — | — | |
| SCHEMBL1334369 | 0.63 | — | — | |
| SCHEMBL19334615 | 0.62 | — | — | |
| SCHEMBL28843255 | 0.62 | TSHR (0.32) | — | |
| SCHEMBL13238350 | 0.59 | HTT (0.30) | — | |
| SCHEMBL681141 | 0.59 | — | — |
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-10978255-B2 | Bichromic bipodal triphenylamine-based dyes with high photo-electron conversion at low light intensities | KOIVISTO BRYAN (CA) | 2021-04-13 | — | — | US | disclosed |