⚠ 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL3129832 | 0.60 | — | — | |
| SCHEMBL7770424 | 0.59 | — | — | |
| Acetic Acid SCHEMBL29253198 | 0.57 | CA1 (0.56) | — | |
| Acetic Acid SCHEMBL27911516 | 0.57 | — | — | |
| Butanedione SCHEMBL15655934 | 0.57 | TSHR (0.54) | — | |
| SCHEMBL28304631 | 0.54 | — | — | |
| Cyclopentanone SCHEMBL8150513 | 0.53 | TRIM24 (0.67) | — | |
| Acetone SCHEMBL6753280 | 0.52 | — | — | |
| Acetone SCHEMBL1652499 | 0.52 | — | — | |
| SCHEMBL934 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1765411-B2 | POLYMER-FACTOR IX MOIETY CONJUGATES | NEKTAR THERAPEUTICS (US) | 2017-10-11 | — | — | EP | disclosed |
| US-7943341-B2 | DNA construct and process for the fermentative production of fusion proteins | WACKER CHEMIE AG (DE) | 2011-05-17 | — | — | US | disclosed |
| US-20080166764-A1 | DNA CONSTRUCT AND PROCESS FOR THE FERMENTATIVE PRODUCTION OF FUSION PROTEINS | WACKER CHEMIE AG (DE) | 2008-07-10 | — | — | US | disclosed |