⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12759573 | 0.96 | — | — | |
| SCHEMBL841533 | 0.82 | RORA (0.31) | — | |
| SCHEMBL840965 | 0.80 | LMNA (0.34) | — | |
| SCHEMBL12759575 | 0.79 | METAP2 (0.39) | — | |
| SCHEMBL840110 | 0.75 | WEE1 (0.32) | — | |
| SCHEMBL841547 | 0.75 | — | — | |
| SCHEMBL841028 | 0.74 | GSK3B (0.33) | — | |
| SCHEMBL839838 | 0.72 | PDE2A (0.33) | — | |
| SCHEMBL842077 | 0.71 | NPC1 (0.37) | — | |
| SCHEMBL861219 | 0.70 | RORA (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150311455-A1 | Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device | UDC IRELAND LTD (IE) | 2015-10-29 | — | — | US | disclosed |