⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15588336 | 0.81 | LMNA (0.38) | — | |
| SCHEMBL5570787 | 0.80 | ALDH1A1 (0.52) | — | |
| SCHEMBL15588284 | 0.80 | — | — | |
| SCHEMBL1548238 | 0.79 | — | — | |
| SCHEMBL15588333 | 0.79 | — | — | |
| SCHEMBL9945575 | 0.78 | MIF (0.31) | — | |
| SCHEMBL33568 | 0.78 | MEN1 (0.42) | — | |
| SCHEMBL15588337 | 0.76 | LMNA (0.34) | — | |
| Ammonia Solution, Strong SCHEMBL21219103 | 0.76 | MEN1 (0.41) | — | |
| SCHEMBL1903650 | 0.76 | MEN1 (0.30) | — |
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-1740679-A2 | LUBRICANT AND FUEL COMPOSITIONS CONTAINING HYDROXY POLYCARBOXYLIC ACID ESTERS | CHEMTURA CORPORATION (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005087904-A2 | LUBRICANT AND FUEL COMPOSITIONS CONTAINING HYDROXY POLYCARBOXYLIC ACID ESTERS | CHEMTURA CORPORATION (US) | 2005-09-22 | — | — | WO | disclosed |