⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22056951 | 0.89 | P2RX7 (0.30) | — | |
| SCHEMBL27254302 | 0.84 | P2RX7 (0.32) | — | |
| SCHEMBL21159911 | 0.83 | — | — | |
| SCHEMBL21160263 | 0.83 | NPC1 (0.41) | — | |
| SCHEMBL27381205 | 0.83 | GPR84 (0.33) | — | |
| SCHEMBL21159670 | 0.82 | NPC1 (0.40) | — | |
| SCHEMBL22809240 | 0.82 | GPR84 (0.32) | — | |
| SCHEMBL21159902 | 0.81 | ACVR1 (0.34) | — | |
| SCHEMBL21160196 | 0.81 | KDM4E (0.33) | — | |
| SCHEMBL27345364 | 0.81 | P2RX7 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3498804-B1 | ORGANIC LIGHT EMITTING DEVICE | LG CHEMICAL LTD (KR) | 2020-06-03 | — | — | EP | disclosed |
| EP-3498804-A1 | ORGANIC LIGHT EMITTING DEVICE | LG Chem, Ltd. (KR) | 2019-06-19 | — | — | EP | disclosed |