⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8075289 | 1.00 | — | — | |
| SCHEMBL31608759 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL24393425 | 0.80 | — | — | |
| SCHEMBL23084028 | 0.79 | — | — | |
| SCHEMBL2234056 | 0.79 | ALDH1A1 (0.38) | — | |
| SCHEMBL11597337 | 0.76 | LMNA (0.36) | — | |
| SCHEMBL10685540 | 0.75 | — | — | |
| SCHEMBL11598222 | 0.74 | ALDH1A1 (0.54) | — | |
| SCHEMBL24393431 | 0.73 | — | — | |
| SCHEMBL11773431 | 0.71 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6071492-A | Cardiac tropism radiopharmaceutical products incorporating a nitride complex of a transition metal and having a rapid myocardial clearance | CIS BIO INTERNATIONAL (FR) | 2000-06-06 | — | — | US | disclosed |