⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18427364 | 0.82 | — | — | |
| SCHEMBL715464 | 0.81 | CHRM2 (0.31) | — | |
| SCHEMBL7997926 | 0.78 | — | — | |
| SCHEMBL816716 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL5669356 | 0.76 | CYP1A2 (0.40) | — | |
| SCHEMBL15134141 | 0.74 | GABRR1 (0.33) | — | |
| SCHEMBL121509 | 0.74 | ALDH1A1 (0.40) | — | |
| SCHEMBL356598 | 0.72 | DNM1 (0.41) | — | |
| SCHEMBL10537504 | 0.72 | KDM4E (0.34) | — | |
| SCHEMBL6790920 | 0.72 | FDPS (0.34) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2051968-B1 | LUMINESCENT MACROCYCLIC LANTHANIDE COMPLEXES | UNIV CALIFORNIA (US) | 2020-04-29 | — | — | EP | disclosed |
| EP-2423201-B1 | Luminescent macrocyclic lanthanide complexes | UNIV CALIFORNIA (US) | 2017-10-04 | — | — | EP | disclosed |
| EP-0840727-B1 | 3-HYDROXY-2(1H)-PYRIDINONE CHELATING AGENTS | UNIV CALIFORNIA (US) | 2004-05-06 | — | — | EP | disclosed |
| EP-0840727-A1 | 3-HYDROXY-2(1H)-PYRIDINONE CHELATING AGENTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-05-13 | — | — | EP | disclosed |
| US-5624901-A | CARBAMOYL SUBSTITUTED COMPOUNDS FOR CHELATE COMPOUNDS FOR MAGNETIC RESONANCE IMAGING | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1997-04-29 | — | — | US | disclosed |
| WO-1997000245-A1 | 3-HYDROXY-2(1H)-PYRIDINONE CHELATING AGENTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1997-01-03 | — | — | WO | disclosed |