⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8186194 | 0.86 | — | — | |
| SCHEMBL8186199 | 0.86 | — | — | |
| SCHEMBL8816523 | 0.82 | RNASE1 (0.45) | — | |
| Hydrochloric Acid SCHEMBL8816179 | 0.81 | — | — | |
| SCHEMBL9780730 | 0.81 | — | — | |
| SCHEMBL9780725 | 0.81 | — | — | |
| SCHEMBL9780687 | 0.81 | — | — | |
| SCHEMBL9780679 | 0.81 | — | — | |
| SCHEMBL9780916 | 0.81 | RNASE1 (0.58) | — | |
| SCHEMBL9780910 | 0.81 | RNASE1 (0.58) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997006178-A1 | PYRIMIDINE NUCLEOSIDES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-02-20 | — | — | WO | disclosed |