⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30454177 | 1.00 | — | — | |
| SCHEMBL114830 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL31458617 | 0.98 | ALDH1A1 (0.49) | — | |
| SCHEMBL10325176 | 0.87 | CYP11B1 (0.43) | — | |
| Glycine SCHEMBL28317162 | 0.85 | ALDH1A1 (0.41) | — | |
| SCHEMBL18368408 | 0.82 | — | — | |
| SCHEMBL2465476 | 0.80 | ALDH1A1 (0.50) | — | |
| SCHEMBL18921523 | 0.79 | ALDH1A1 (0.45) | — | |
| SCHEMBL18921524 | 0.79 | ALDH1A1 (0.45) | — | |
| SCHEMBL29773863 | 0.79 | ALDH1A1 (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8197793-B2 | Methods of radiofluorination of biologically active vectors | GE HEALTHCARE AS (NO) | 2012-06-12 | — | — | US | disclosed |
| US-20100068139-A1 | Methods of radiofluorination of biologically active vectors | GE HEALTHCARE AS (NO) | 2010-03-18 | — | — | US | disclosed |