⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10958644 | 1.00 | — | — | |
| SCHEMBL27476550 | 0.81 | — | — | |
| SCHEMBL10416346 | 0.81 | CA1 (0.30) | — | |
| SCHEMBL1714209 | 0.75 | — | — | |
| SCHEMBL1714210 | 0.75 | — | — | |
| SCHEMBL6582271 | 0.74 | — | — | |
| SCHEMBL6582266 | 0.74 | — | — | |
| SCHEMBL891810 | 0.73 | — | — | |
| SCHEMBL17613420 | 0.73 | — | — | |
| SCHEMBL5670484 | 0.73 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0971904-A1 | NOVEL 1-AMINO-3 BENZYL URACILS | BASF AKTIENGESELLSCHAFT (DE) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998042682-A1 | NOVEL 1-AMINO-3 BENZYL URACILS | BASF AKTIENGESELLSCHAFT (DE) | 1998-10-01 | — | — | WO | disclosed |
| US-4518531-A | Allylic chlorination process and compounds prepared thereby | ELI LILLY AND COMPANY (US) | 1985-05-21 | — | — | US | disclosed |
| US-4430268-A | Allylic chlorination process | ELI LILLY AND COMPANY (US) | 1984-02-07 | — | — | US | disclosed |
| EP-0019387-A1 | Thiazolinoazetidinone compounds useful as intermediates for preparing cephalosporins and a process for their preparation | ELI LILLY AND COMPANY (US) | 1980-11-26 | — | — | EP | disclosed |