⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22898732 | 0.89 | MAPT (0.34) | — | |
| SCHEMBL24283100 | 0.77 | — | — | |
| SCHEMBL22448436 | 0.77 | MAPT (0.39) | — | |
| SCHEMBL26024070 | 0.74 | — | — | |
| SCHEMBL18676805 | 0.74 | — | — | |
| SCHEMBL22147040 | 0.74 | — | — | |
| SCHEMBL19421378 | 0.73 | SMN1; SMN2 (0.43) | — | |
| SCHEMBL19723959 | 0.72 | CYP2A6 (0.36) | — | |
| SCHEMBL24860210 | 0.71 | SMN1; SMN2 (0.48) | — | |
| SCHEMBL18868807 | 0.71 | LMNA (0.40) | — |
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-2749625-B1 | ORGANIC LIGHT EMITTING DIODE | LG CHEMICAL LTD (KR) | 2017-12-20 | — | — | EP | disclosed |