⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13428351 | 0.79 | P2RX4 (0.37) | — | |
| SCHEMBL13428385 | 0.71 | P2RX4 (0.37) | — | |
| SCHEMBL13540633 | 0.67 | — | — | |
| SCHEMBL24891114 | 0.66 | P2RX4 (0.31) | — | |
| SCHEMBL13428344 | 0.65 | POLB (0.41) | — | |
| SCHEMBL13428350 | 0.65 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL14244249 | 0.63 | P2RX4 (0.47) | — | |
| SCHEMBL31414163 | 0.63 | P2RX4 (0.47) | — | |
| SCHEMBL30547086 | 0.63 | P2RX4 (0.47) | — | |
| SCHEMBL13158711 | 0.62 | PRKDC (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2256176-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | Gracel Display Inc. (KR) | 2010-12-01 | — | — | EP | disclosed |