⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3522154 | 0.71 | — | — | |
| SCHEMBL13953187 | 0.59 | — | — | |
| SCHEMBL22555574 | 0.58 | — | — | |
| SCHEMBL466965 | 0.57 | — | — | |
| SCHEMBL2847937 | 0.57 | — | — | |
| SCHEMBL9744433 | 0.56 | — | — | |
| SCHEMBL4797006 | 0.55 | PABPC1 (0.33) | — | |
| SCHEMBL3811064 | 0.55 | — | — | |
| SCHEMBL21633743 | 0.55 | — | — | |
| SCHEMBL22389533 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1512399-A1 | PORPHYRIN OXYGEN INFUSION PREPARATION FOR INCREASING OXYGEN CONCENTRATION IN TUMOR TISSUE | Nipro Corporation (JP) | 2005-03-09 | — | — | EP | disclosed |