⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8663008 | 0.79 | — | — | |
| SCHEMBL10961080 | 0.77 | TSHR (0.30) | — | |
| SCHEMBL6425877 | 0.75 | PTPN7 (0.32) | — | |
| SCHEMBL9794198 | 0.74 | PTPN7 (0.35) | — | |
| SCHEMBL4469415 | 0.72 | — | — | |
| SCHEMBL336315 | 0.72 | — | — | |
| SCHEMBL20658212 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL640225 | 0.69 | — | — | |
| SCHEMBL14914835 | 0.65 | RAB9A (0.33) | — | |
| SCHEMBL8951503 | 0.65 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5763461-A | ANTIPICORNAVIRAL AGENTS | SANOFI (FR) | 1998-06-09 | — | — | US | disclosed |
| US-5618821-A | VIRICIDES, PICORNAVIRUS | SANOFI, S.A. (FR) | 1997-04-08 | — | — | US | disclosed |
| WO-1995031438-A1 | THERAPEUTIC PHENOXYALKYLHETEROCYCLES | SANOFI WINTHROP, INC. (US) | 1995-11-23 | — | — | WO | disclosed |