⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4353459 | 0.78 | MEN1 (0.48) | — | |
| SCHEMBL17754788 | 0.75 | — | — | |
| SCHEMBL13314085 | 0.75 | — | — | |
| SCHEMBL17563224 | 0.74 | CHRNB2 (0.30) | — | |
| SCHEMBL12140662 | 0.69 | IDH1 (0.32) | — | |
| SCHEMBL29319788 | 0.67 | NQO1 (0.52) | — | |
| SCHEMBL21889559 | 0.66 | MAPT (0.45) | — | |
| SCHEMBL17177982 | 0.65 | TSHR (0.39) | — | |
| SCHEMBL19057931 | 0.64 | L3MBTL1 (0.37) | — | |
| SCHEMBL12693559 | 0.64 | CA1 (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-7727640-B2 | Organic electroluminescent element | FUJIFILM CORPORATION (JP) | 2010-06-01 | — | — | US | disclosed |
| US-7727640-B2 | Organic electroluminescent element | FUJIFILM CORPORATION (JP) | 2010-06-01 | — | — | US | disclosed |