⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10595625 | 1.00 | — | — | |
| Bromide SCHEMBL10398773 | 0.95 | — | — | |
| SCHEMBL16442474 | 0.73 | — | — | |
| SCHEMBL8387290 | 0.70 | — | — | |
| SCHEMBL16077235 | 0.70 | — | — | |
| SCHEMBL12538049 | 0.70 | — | — | |
| SCHEMBL269291 | 0.67 | — | — | |
| SCHEMBL15196306 | 0.67 | — | — | |
| SCHEMBL14607261 | 0.67 | — | — | |
| SCHEMBL269447 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011095126-A1 | SYNTHESIS PROCESS OF DASATINIB AND INTERMEDIATE THEREOF | 南京卡文迪许生物工程技术有限公司 (CN) | 2011-08-11 | — | — | WO | disclosed |