⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23544594 | 0.69 | — | — | |
| SCHEMBL22725530 | 0.69 | — | — | |
| SCHEMBL2756155 | 0.69 | NPSR1 (0.36) | — | |
| SCHEMBL26178983 | 0.68 | DRD2 (0.36) | — | |
| SCHEMBL26178987 | 0.68 | MAPK1 (0.43) | — | |
| SCHEMBL17050408 | 0.66 | JAK2 (0.30) | — | |
| SCHEMBL12749943 | 0.66 | NOS3 (0.45) | — | |
| SCHEMBL1101901 | 0.66 | HRH4 (0.40) | — | |
| SCHEMBL30042287 | 0.66 | NOS3 (0.45) | — | |
| SCHEMBL15479692 | 0.66 | NOS3 (0.50) | — |
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-20230219927-A1 | AKT3 MODULATORS | Georgiamune Inc. | 2023-07-13 | — | — | US | disclosed |