⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL106970 | 0.69 | ADRA2C (0.35) | — | |
| SCHEMBL20278694 | 0.69 | ADRA2C (0.35) | — | |
| SCHEMBL110450 | 0.67 | ALDH1A1 (0.39) | — | |
| SCHEMBL18671412 | 0.67 | — | — | |
| SCHEMBL22895257 | 0.67 | ALDH1A1 (0.39) | — | |
| SCHEMBL14838766 | 0.67 | — | — | |
| SCHEMBL594386 | 0.65 | — | — | |
| SCHEMBL12425132 | 0.65 | POLB (0.33) | — | |
| SCHEMBL8597143 | 0.64 | ADRA2C (0.38) | — | |
| SCHEMBL878973 | 0.63 | F2 (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1968651-B1 | STABILIZED COMPOSITIONS AND METHODS FOR RADIOLABELING PHARMACEUTICALS WITH ALPHA-PARTICLE EMITTERS | UNIV DUKE (US) | 2013-03-13 | — | — | EP | disclosed |
| US-8337810-B2 | Stabilized compositions and methods for radiolabeling pharmaceuticals with alpha-particle emitters | DUKE UNIVERSITY (US) | 2012-12-25 | — | — | US | disclosed |
| US-20090304585-A1 | Stabilized Compositions and Methods for Radiolabeling Pharmaceuticals with Alpha-Particle Emitters | DUKE UNIVERSITY (US) | 2009-12-10 | — | — | US | disclosed |