⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13900999 | 0.75 | — | — | |
| SCHEMBL13077982 | 0.73 | — | — | |
| SCHEMBL22201958 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL22202016 | 0.70 | — | — | |
| SCHEMBL11845472 | 0.69 | GRM5 (0.36) | — | |
| SCHEMBL9812155 | 0.66 | MAPT (0.40) | — | |
| SCHEMBL12569937 | 0.65 | — | — | |
| SCHEMBL8617283 | 0.63 | — | — | |
| SCHEMBL149594 | 0.63 | — | — | |
| SCHEMBL16498026 | 0.63 | — | — |
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-7501427-B2 | Quinazoline analogs as receptor tyrosine kinase inhibitors | ARRAY BIOPHARMA, INC. (US) | 2009-03-10 | — | — | US | disclosed |