⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13446387 | 0.87 | CNR1 (0.31) | — | |
| SCHEMBL12611647 | 0.87 | — | — | |
| SCHEMBL13930218 | 0.80 | CNR1 (0.34) | — | |
| SCHEMBL13446388 | 0.78 | MAPT (0.33) | — | |
| SCHEMBL12123457 | 0.76 | — | — | |
| SCHEMBL12123458 | 0.76 | — | — | |
| SCHEMBL12887016 | 0.75 | — | — | |
| SCHEMBL19214015 | 0.75 | ELANE (0.31) | — | |
| SCHEMBL13208040 | 0.75 | CNR1 (0.30) | — | |
| SCHEMBL12131166 | 0.75 | GPR84 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8298686-B2 | Composition and organic photoelectric converter using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-10-30 | — | — | US | disclosed |
| US-20100327271-A1 | COMPOSITION AND ORGANIC PHOTOELECTRIC CONVERTER USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-12-30 | — | — | US | disclosed |