⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3635858 | 0.78 | — | — | |
| SCHEMBL9650162 | 0.78 | — | — | |
| SCHEMBL3868041 | 0.76 | — | — | |
| SCHEMBL28405097 | 0.76 | ALDH1A1 (0.40) | — | |
| SCHEMBL120801 | 0.75 | — | — | |
| SCHEMBL20200130 | 0.75 | — | — | |
| SCHEMBL22332871 | 0.75 | — | — | |
| SCHEMBL20200727 | 0.75 | — | — | |
| SCHEMBL20200726 | 0.75 | — | — | |
| SCHEMBL20200719 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114096642-B | Method for removing and converting amine in refinery desalters | BL 科技公司 | 2024-03-01 | — | — | CN | claimed |
| EP-2158242-B1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | DORF KETAL CHEMICALS INDIA PRIVATE LTD (IN) | 2019-12-25 | — | — | EP | disclosed |
| EP-2158242-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | Johnson Matthey PLC (GB) | 2010-03-03 | — | — | EP | disclosed |
| WO-2008155569-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | JOHNSON MATTHEY PLC (GB) | 2008-12-24 | — | — | WO | disclosed |