⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25964737 | 0.80 | KDM4E (0.37) | — | |
| SCHEMBL21348124 | 0.80 | PIK3CD (0.31) | — | |
| SCHEMBL27461124 | 0.79 | — | — | |
| SCHEMBL25965444 | 0.79 | KDM4E (0.36) | — | |
| SCHEMBL25965004 | 0.79 | KDM4E (0.34) | — | |
| SCHEMBL26005669 | 0.78 | PTGER4 (0.35) | — | |
| SCHEMBL26146641 | 0.77 | KDM4E (0.35) | — | |
| SCHEMBL25929246 | 0.76 | PTGER4 (0.36) | — | |
| SCHEMBL22352382 | 0.76 | L3MBTL1 (0.39) | — | |
| SCHEMBL25964745 | 0.76 | KDM4E (0.39) | — |
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-20230255106-A1 | ORGANIC ELECTROLUMINESCENT APPARATUS | MERCK PATENT GMBH (DE) | 2023-08-10 | — | — | US | disclosed |