⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL784611 | 0.80 | ALDH1A1 (0.34) | — | |
| SCHEMBL12206794 | 0.77 | ADORA2A (0.36) | — | |
| SCHEMBL14769830 | 0.76 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL17282462 | 0.74 | KDM4E (0.33) | — | |
| SCHEMBL14769820 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL12154069 | 0.74 | KDM4E (0.32) | — | |
| SCHEMBL23187794 | 0.73 | GPR84 (0.37) | — | |
| SCHEMBL22348797 | 0.73 | GPR84 (0.37) | — | |
| SCHEMBL21392460 | 0.73 | LMNA (0.33) | — | |
| SCHEMBL15468852 | 0.69 | ADORA2A (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10745435-B2 | Nucleic acid prodrugs | CERECOR, INC. (US) | 2020-08-18 | — | — | US | disclosed |
| US-20190290670-A1 | METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS | IDENIX PHARMACEUTICALS LLC (US) | 2019-09-26 | — | — | US | disclosed |
| US-20130149283-A1 | METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS | UNIVERSITA DEGLI STUDI DI CAGLIARI (IT) | 2013-06-13 | — | — | US | disclosed |