⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7754353 | 1.00 | — | — | |
| SCHEMBL7755110 | 0.85 | — | — | |
| SCHEMBL7755105 | 0.85 | — | — | |
| SCHEMBL7753966 | 0.82 | LPAR3 (0.32) | — | |
| SCHEMBL7754323 | 0.80 | LPAR3 (0.35) | — | |
| SCHEMBL4966314 | 0.80 | — | — | |
| SCHEMBL5404270 | 0.80 | — | — | |
| SCHEMBL7755345 | 0.79 | LPAR3 (0.38) | — | |
| SCHEMBL1774804 | 0.78 | FAAH (0.44) | — | |
| SCHEMBL1774805 | 0.78 | FAAH (0.44) | — |
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-0835248-B1 | 1-AMINO-3-BENZYLURACILS | BASF AG (DE) | 2001-02-21 | — | — | EP | disclosed |
| CN-1189824-A | 1-amino-3-benzyluracils | BASF AG (DE) | 1998-08-05 | — | — | CN | disclosed |
| EP-0835248-A1 | 1-AMINO-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1998-04-15 | — | — | EP | disclosed |
| WO-1997001543-A1 | 1-AMINO-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1997-01-16 | — | — | WO | disclosed |