⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9555656 | 0.84 | NPSR1 (0.31) | — | |
| SCHEMBL9555754 | 0.84 | NPSR1 (0.31) | — | |
| SCHEMBL9417253 | 0.84 | — | — | |
| SCHEMBL9858222 | 0.84 | — | — | |
| SCHEMBL9858217 | 0.84 | — | — | |
| SCHEMBL9684244 | 0.80 | — | — | |
| SCHEMBL9857577 | 0.79 | — | — | |
| SCHEMBL9676871 | 0.77 | — | — | |
| SCHEMBL9676830 | 0.77 | — | — | |
| SCHEMBL9295755 | 0.75 | — | — |
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-5055458-A | PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY | BEECHAM GROUP P.L.C. (GB) | 1991-10-08 | — | — | US | disclosed |
| EP-0353955-A2 | Novel compounds | BEECHAM GROUP PLC (GB) | 1990-02-07 | — | — | EP | disclosed |