⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14849361 | 0.88 | — | — | |
| SCHEMBL22132259 | 0.86 | EGFR (0.30) | — | |
| SCHEMBL14849427 | 0.83 | TSPO (0.34) | — | |
| SCHEMBL14849246 | 0.83 | TSPO (0.32) | — | |
| SCHEMBL14849409 | 0.83 | TSPO (0.34) | — | |
| SCHEMBL4402880 | 0.83 | — | — | |
| SCHEMBL13978079 | 0.82 | KDM4E (0.32) | — | |
| SCHEMBL14849357 | 0.82 | TSPO (0.33) | — | |
| SCHEMBL14849431 | 0.82 | TSPO (0.35) | — | |
| SCHEMBL14849400 | 0.82 | TSPO (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130087776-A1 | COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME | CHEIL INDUSTRIES, INC. (KR) | 2013-04-11 | — | — | US | disclosed |
| US-20130087776-A1 | COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME | CHEIL INDUSTRIES, INC. (KR) | 2013-04-11 | — | — | US | disclosed |