⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2402021 | 0.83 | — | — | |
| Methacrylic Acid SCHEMBL9902944 | 0.76 | — | — | |
| SCHEMBL6355179 | 0.75 | — | — | |
| SCHEMBL9621943 | 0.75 | — | — | |
| SCHEMBL8745223 | 0.74 | — | — | |
| SCHEMBL14830888 | 0.72 | — | — | |
| SCHEMBL8215477 | 0.65 | — | — | |
| SCHEMBL409648 | 0.65 | — | — | |
| SCHEMBL28803414 | 0.65 | — | — | |
| SCHEMBL9619591 | 0.64 | ALDH1A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1469951-B1 | HARDENED MATERIALS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF | BASF COATINGS AG (DE) | 2006-07-05 | — | — | EP | disclosed |
| EP-1470448-B1 | MIXTURE OF SUBSTANCES WHICH CAN BE HARDENED BY HEAT AND BY ACTINIC RADIATION, METHOD FOR THE PRODUCTION AND USE THEREOF | BASF COATINGS AG (DE) | 2006-06-28 | — | — | EP | disclosed |
| EP-1469951-A1 | HARDENED MATERIALS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF | BASF Coatings AG (DE) | 2004-10-27 | — | — | EP | disclosed |
| WO-2003061849-A1 | HARDENED MATERIALS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF | BASF COATINGS AG (DE) | 2003-07-31 | — | — | WO | disclosed |