⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9626854 | 0.76 | — | — | |
| SCHEMBL9625946 | 0.73 | ABAT (0.33) | — | |
| SCHEMBL10643890 | 0.71 | PRCP (0.38) | — | |
| SCHEMBL87312 | 0.68 | CYP3A4 (0.32) | — | |
| Hydrochloric Acid SCHEMBL572769 | 0.66 | CYP3A4 (0.31) | — | |
| Iodide SCHEMBL2341578 | 0.66 | CYP3A4 (0.31) | — | |
| Bromide SCHEMBL1045354 | 0.66 | CYP3A4 (0.31) | — | |
| SCHEMBL5124046 | 0.66 | — | — | |
| SCHEMBL28685289 | 0.63 | — | — | |
| SCHEMBL7167963 | 0.63 | — | — |
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-0366171-B1 | NUCLEOSIDE DERIVATIVES | NYCOMED AS (NO) | 1992-05-06 | — | — | EP | disclosed |
| EP-0437527-A1 | NUCLEOSIDE DERIVATIVES | NYCOMED AS (NO) | 1991-07-24 | — | — | EP | disclosed |
| WO-1990004603-A1 | NUCLEOSIDE DERIVATIVES | NYCOMED AS (NO) | 1990-05-03 | — | — | WO | disclosed |
| EP-0366171-A1 | Nucleoside derivatives | NYCOMED AS (NO) | 1990-05-02 | — | — | EP | disclosed |