⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21725704 | 0.78 | — | — | |
| SCHEMBL18789823 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL15183951 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL16274546 | 0.73 | HSD17B10 (0.38) | — | |
| SCHEMBL22766001 | 0.72 | — | — | |
| SCHEMBL14292313 | 0.72 | — | — | |
| SCHEMBL24869232 | 0.71 | — | — | |
| SCHEMBL11501648 | 0.71 | ALDH1A1 (0.71) | — | |
| SCHEMBL12824734 | 0.71 | — | — | |
| SCHEMBL18519461 | 0.71 | — | — |
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-20200385394-A1 | 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES | Impact Therapeutics (Shanghai), Inc (CN) | 2020-12-10 | — | — | US | disclosed |