⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27963008 | 0.92 | — | — | |
| SCHEMBL3864986 | 0.80 | — | — | |
| SCHEMBL3895632 | 0.78 | TSHR (0.37) | — | |
| SCHEMBL11040223 | 0.78 | TSHR (0.37) | — | |
| SCHEMBL3863064 | 0.78 | TSHR (0.44) | — | |
| SCHEMBL99628 | 0.77 | — | — | |
| SCHEMBL367042 | 0.77 | — | — | |
| SCHEMBL598125 | 0.77 | TSHR (0.41) | — | |
| SCHEMBL10999837 | 0.76 | TSHR (0.42) | — | |
| SCHEMBL3886927 | 0.76 | TSHR (0.42) | — |
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-8884011-B2 | Nucleotide analogues as precursor molecules for antivirals | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS (FR) | 2014-11-11 | — | — | US | disclosed |
| US-20100099869-A1 | NOVEL NUCLEOTIDE ANALOGUES AS PRECUSOR MOLECULES FOR ANTIVIRALS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS (FR) | 2010-04-22 | — | — | US | disclosed |