⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5829334 | 0.77 | — | — | |
| SCHEMBL5689042 | 0.76 | — | — | |
| SCHEMBL895967 | 0.74 | TDP1 (0.42) | — | |
| SCHEMBL134504 | 0.72 | — | — | |
| SCHEMBL28066135 | 0.70 | TDP1 (0.37) | — | |
| SCHEMBL18432852 | 0.69 | — | — | |
| SCHEMBL13863421 | 0.68 | — | — | |
| SCHEMBL17661769 | 0.68 | — | — | |
| SCHEMBL18678930 | 0.68 | — | — | |
| SCHEMBL20906489 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1631645-A1 | FUEL COMPOUND EXHIBITING IMPROVED COLD FLOW PROPERTIES | BASF AKTIENGESELLSCHAFT (DE) | 2006-03-08 | — | — | EP | disclosed |
| WO-2004106470-A1 | FUEL COMPOUND EXHIBITING IMPROVED COLD FLOW PROPERTIES | BASF AKTIENGESELLSCHAFT (DE) | 2004-12-09 | — | — | WO | disclosed |