⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18909472 | 0.74 | — | — | |
| SCHEMBL18909345 | 0.70 | — | — | |
| SCHEMBL25401287 | 0.70 | — | — | |
| SCHEMBL2879713 | 0.69 | — | — | |
| SCHEMBL3920698 | 0.69 | — | — | |
| SCHEMBL23514570 | 0.69 | KDM1A (0.34) | — | |
| SCHEMBL24890877 | 0.69 | KDM1A (0.45) | — | |
| SCHEMBL23583702 | 0.69 | KDM1A (0.34) | — | |
| SCHEMBL25317589 | 0.67 | KDM1A (0.37) | — | |
| SCHEMBL24890838 | 0.66 | KDM1A (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2321319-A1 | ANTIVIRAL COMPOUNDS | Gilead Sciences, Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| WO-2010011959-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2010-01-28 | — | — | WO | disclosed |