⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16914607 | 0.77 | — | — | |
| SCHEMBL16914582 | 0.77 | — | — | |
| SCHEMBL7668565 | 0.57 | TAAR1 (0.35) | — | |
| SCHEMBL16914564 | 0.54 | — | — | |
| SCHEMBL16914600 | 0.54 | KRAS (0.34) | — | |
| SCHEMBL9518328 | 0.50 | ADRA1A (0.41) | — | |
| SCHEMBL13762328 | 0.49 | — | — | |
| SCHEMBL5591412 | 0.47 | — | — | |
| SCHEMBL19897498 | 0.47 | — | — | |
| SCHEMBL501768 | 0.46 | RXRA (0.42) | — |
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-11780856-B2 | Compound and organic light-emitting device comprising same | LG CHEM, LTD. (KR) | 2023-10-10 | — | — | US | disclosed |
| EP-3919500-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LG CHEM, LTD. (KR) | 2021-12-08 | — | — | EP | disclosed |