⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20857787 | 0.86 | KDM4E (0.35) | — | |
| SCHEMBL20857780 | 0.83 | MAPT (0.37) | — | |
| SCHEMBL21718194 | 0.82 | PGR (0.33) | — | |
| SCHEMBL21126730 | 0.81 | PGR (0.33) | — | |
| SCHEMBL21718212 | 0.80 | PGR (0.32) | — | |
| SCHEMBL21718170 | 0.80 | PGR (0.30) | — | |
| SCHEMBL20857776 | 0.80 | PDK2 (0.32) | — | |
| SCHEMBL24026757 | 0.80 | — | — | |
| SCHEMBL24026756 | 0.79 | — | — | |
| SCHEMBL24026763 | 0.79 | — | — |
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-20190221747-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND NOVEL COMPOUND | IDEMITSU KOSAN CO., LTD. (JP) | 2019-07-18 | — | — | US | disclosed |