⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9200223 | 0.95 | — | — | |
| SCHEMBL9202345 | 0.87 | — | — | |
| SCHEMBL9200689 | 0.83 | — | — | |
| SCHEMBL8872688 | 0.72 | LMNA (0.30) | — | |
| SCHEMBL7661074 | 0.71 | KMT2A (0.40) | — | |
| SCHEMBL9359135 | 0.65 | GRIK1 (0.50) | — | |
| SCHEMBL6545351 | 0.65 | THRA (0.32) | — | |
| SCHEMBL6219513 | 0.65 | GRIK1 (0.33) | — | |
| SCHEMBL28059799 | 0.59 | CNR2 (0.33) | — | |
| SCHEMBL8698658 | 0.58 | DAO (0.49) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0647225-A1 | 3-ARYLURACIL DERIVATIVES AND THEIR USE AS HERBICIDES | Novartis AG (CH) | 1995-04-12 | — | — | EP | disclosed |