⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21369811 | 0.97 | — | — | |
| SCHEMBL8737529 | 0.96 | CYP11B1 (0.31) | — | |
| SCHEMBL21370220 | 0.94 | PDK2 (0.32) | — | |
| SCHEMBL21369812 | 0.94 | — | — | |
| SCHEMBL21369785 | 0.92 | PDK2 (0.31) | — | |
| SCHEMBL8734552 | 0.92 | CYP11B1 (0.31) | — | |
| SCHEMBL21369680 | 0.91 | PDK2 (0.30) | — | |
| SCHEMBL8737009 | 0.91 | MEN1 (0.30) | — | |
| SCHEMBL21369952 | 0.91 | — | — | |
| SCHEMBL21369770 | 0.90 | PDK2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20190288215-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME | SOULBRAIN CO., LTD. (KR) | 2019-09-19 | — | — | US | disclosed |