⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11352926 | 0.74 | — | — | |
| SCHEMBL107136 | 0.72 | — | — | |
| SCHEMBL13168505 | 0.72 | ALDH1A1 (0.35) | — | |
| SCHEMBL92168 | 0.70 | — | — | |
| SCHEMBL11486026 | 0.70 | — | — | |
| Fluoride SCHEMBL5410642 | 0.70 | — | — | |
| SCHEMBL13960529 | 0.70 | — | — | |
| SCHEMBL2755520 | 0.69 | — | — | |
| SCHEMBL7642854 | 0.69 | — | — | |
| SCHEMBL2238876 | 0.67 | — | — |
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-8557145-B2 | Conductive polymer compound and organic photoelectric device including same | CHEIL INDUSTRIES, INC. (KR) | 2013-10-15 | — | — | US | disclosed |