⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL328731 | 0.97 | — | — | |
| SCHEMBL28585478 | 0.94 | — | — | |
| SCHEMBL28912697 | 0.86 | TET2 (0.50) | — | |
| SCHEMBL10614825 | 0.84 | TET2 (0.60) | — | |
| SCHEMBL27659038 | 0.81 | TET2 (0.57) | — | |
| SCHEMBL1258357 | 0.79 | — | — | |
| SCHEMBL10599631 | 0.78 | TET2 (0.60) | — | |
| SCHEMBL23927578 | 0.77 | — | — | |
| SCHEMBL326464 | 0.77 | — | — | |
| SCHEMBL8655218 | 0.77 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6572972-B2 | Mixture of organobismuth compound and epoxy resin binder | SOLUTIA AUSTRIA GMBH (AT) | 2003-06-03 | — | — | US | disclosed |
| US-20030021999-A1 | Aqueous binders | MONCHEM INTERNATIONAL, INC. | 2003-01-30 | — | — | US | disclosed |