⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12082127 | 0.77 | NPC1 (0.43) | — | |
| SCHEMBL792423 | 0.77 | — | — | |
| SCHEMBL6237757 | 0.77 | — | — | |
| SCHEMBL4813856 | 0.76 | — | — | |
| SCHEMBL15177751 | 0.76 | — | — | |
| SCHEMBL6859349 | 0.75 | ALDH1A1 (0.43) | — | |
| SCHEMBL5581818 | 0.74 | — | — | |
| SCHEMBL5581821 | 0.74 | — | — | |
| SCHEMBL3905585 | 0.74 | — | — | |
| SCHEMBL23323561 | 0.74 | — | — |
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-20040014776-A1 | Imidazolo-5-YL-2anilino-pyrimidines as agents for the inhibition of the cell proliffration | ASTRAZENECA AB (SE) | 2004-01-22 | — | — | US | disclosed |