⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20172939 | 0.89 | ALDH1A1 (0.31) | — | |
| SCHEMBL20172942 | 0.88 | SIGMAR1 (0.30) | — | |
| SCHEMBL20172889 | 0.85 | ALDH1A1 (0.34) | — | |
| SCHEMBL20650752 | 0.85 | — | — | |
| SCHEMBL20172881 | 0.84 | ALDH1A1 (0.30) | — | |
| SCHEMBL20172873 | 0.83 | GPR3 (0.37) | — | |
| SCHEMBL20172923 | 0.83 | ACP1 (0.34) | — | |
| SCHEMBL20172885 | 0.81 | ACHE (0.37) | — | |
| SCHEMBL21021038 | 0.81 | SIGMAR1 (0.33) | — | |
| SCHEMBL21021480 | 0.81 | NPC1 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10651411-B2 | Compound and organic light emitting device containing same | LG CHEM, LTD. (KR) | 2020-05-12 | — | — | US | disclosed |
| US-20190152919-A1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG CHEM, LTD. (KR) | 2019-05-23 | — | — | US | disclosed |
| US-20180145272-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME | LG CHEM, LTD. (KR) | 2018-05-24 | — | — | US | disclosed |
| US-20180145272-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME | LG CHEM, LTD. (KR) | 2018-05-24 | — | — | US | disclosed |