⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1278394 | 0.61 | TYR (0.45) | — | |
| SCHEMBL31398713 | 0.56 | — | — | |
| SCHEMBL32681765 | 0.56 | — | — | |
| SCHEMBL32681764 | 0.56 | — | — | |
| SCHEMBL29883429 | 0.56 | — | — | |
| SCHEMBL10598321 | 0.55 | MEN1 (0.37) | — | |
| SCHEMBL24520593 | 0.54 | — | — | |
| SCHEMBL10631311 | 0.53 | — | — | |
| SCHEMBL4284220 | 0.53 | — | — | |
| SCHEMBL11543104 | 0.52 | — | — |
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-2012045114-A1 | AGENTS AND METHODS FOR TREATING HEMATOLOGIC CONDITIONS | THE UNIVERSITY OF QUEENSLAND (AU) | 2012-04-12 | — | — | WO | disclosed |