⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2814340 | 0.88 | ALDH1A1 (0.43) | — | |
| SCHEMBL17360020 | 0.79 | HPGD (0.42) | — | |
| SCHEMBL7886617 | 0.78 | BCHE (0.32) | — | |
| SCHEMBL601373 | 0.78 | BCHE (0.53) | — | |
| SCHEMBL7266735 | 0.75 | ALDH1A1 (0.38) | — | |
| SCHEMBL1078049 | 0.75 | ALDH1A1 (0.57) | — | |
| SCHEMBL4640870 | 0.75 | — | — | |
| SCHEMBL2373181 | 0.75 | — | — | |
| SCHEMBL10851800 | 0.74 | ADORA3 (0.33) | — | |
| SCHEMBL18027810 | 0.74 | ALDH1A1 (0.44) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2550037-B1 | PHARMACEUTICAL COMPOSITION CONTAINING CYCLODEXTRIN COPOLYMER | FRESENIUS MEDICAL CARE DEUTSCHLAND GMBH (DE) | 2018-05-16 | — | — | EP | disclosed |
| EP-2550037-A1 | PHARMACEUTICAL COMPOSITION CONTAINING CYCLODEXTRIN COPOLYMER | Fresenius Medical Care Deutschland GmbH (DE) | 2013-01-30 | — | — | EP | disclosed |
| WO-2011116908-A1 | PHARMACEUTICAL COMPOSITION CONTAINING CYCLODEXTRIN COPOLYMER | FRESENIUS MEDICAL CARE DEUTSCHLAND GMBH (DE) | 2011-09-29 | — | — | WO | disclosed |
| WO-1982000643-A1 | SUBSTITUTED OXIRANECARBONIC ACIDS,PREPARATION AND PHARMACEUTICAL UTILISATION THEREOF | BYK GULDEN LOMBERG CHEM FAB (DE) | 1982-03-04 | — | — | WO | disclosed |