⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3098679 | 0.87 | — | — | |
| SCHEMBL11779303 | 0.75 | — | — | |
| SCHEMBL2507 | 0.71 | — | — | |
| SCHEMBL1339 | 0.71 | — | — | |
| SCHEMBL9321553 | 0.71 | — | — | |
| SCHEMBL10545140 | 0.71 | — | — | |
| Methane SCHEMBL29598993 | 0.71 | — | — | |
| SCHEMBL15794752 | 0.67 | — | — | |
| SCHEMBL15794422 | 0.58 | — | — | |
| SCHEMBL15813054 | 0.58 | — | — |
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-2015198249-A1 | PROCESS FOR PREPARATION OF BOSUTINIB | SHILPA MEDICARE LIMITED (IN) | 2015-12-30 | — | — | WO | disclosed |