⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3015969 | 0.90 | CA12 (0.48) | — | |
| SCHEMBL1644428 | 0.89 | CA12 (0.50) | — | |
| SCHEMBL28834532 | 0.88 | CA12 (0.50) | — | |
| SCHEMBL24459735 | 0.86 | CA12 (0.48) | — | |
| SCHEMBL10537471 | 0.84 | CA12 (0.58) | — | |
| SCHEMBL4172955 | 0.83 | PKM (0.35) | — | |
| SCHEMBL3016246 | 0.83 | GABRR1 (0.39) | — | |
| SCHEMBL17677147 | 0.83 | GABRR1 (0.39) | — | |
| SCHEMBL6696856 | 0.82 | — | — | |
| SCHEMBL1408867 | 0.82 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100189656-A1 | CONTRAST AGENTS | GE HEALTHCARE AS (NO) | 2010-07-29 | — | — | US | disclosed |
| US-20100189656-A1 | CONTRAST AGENTS | GE HEALTHCARE AS (NO) | 2010-07-29 | — | — | US | disclosed |
| US-20100189656-A1 | CONTRAST AGENTS | GE HEALTHCARE AS (NO) | 2010-07-29 | — | — | US | disclosed |
| WO-2009005364-A1 | CONTRAST AGENTS | GE HEALTHCARE AS (NO) | 2009-01-08 | — | — | WO | disclosed |
| WO-2009005364-A1 | CONTRAST AGENTS | GE HEALTHCARE AS (NO) | 2009-01-08 | — | — | WO | disclosed |