⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29919448 | 0.80 | — | — | |
| SCHEMBL17627917 | 0.59 | — | — | |
| SCHEMBL7763356 | 0.57 | — | — | |
| SCHEMBL16914146 | 0.56 | EPHX1 (0.34) | — | |
| SCHEMBL6892481 | 0.56 | EPHX1 (0.32) | — | |
| SCHEMBL39079 | 0.56 | EPHX1 (0.32) | — | |
| SCHEMBL40172 | 0.54 | EPHX1 (0.42) | — | |
| SCHEMBL25423540 | 0.53 | — | — | |
| SCHEMBL11069650 | 0.53 | — | — | |
| SCHEMBL23933136 | 0.52 | — | — |
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-1861485-A1 | ANTIWEAR LUBRICANT COMPOSITIONS FOR USE IN COMBUSTION ENGINES | Ciba Specialty Chemicals Holding Inc. (CH) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006100188-A1 | ANTIWEAR LUBRICANT COMPOSITIONS FOR USE IN COMBUSTION ENGINES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2006-09-28 | — | — | WO | disclosed |