⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8841758 | 0.82 | PPARD (0.39) | — | |
| SCHEMBL6210416 | 0.76 | S1PR2 (0.37) | — | |
| SCHEMBL2776800 | 0.73 | — | — | |
| SCHEMBL1534444 | 0.70 | MMP1 (0.33) | — | |
| SCHEMBL8668678 | 0.70 | MMP1 (0.33) | — | |
| SCHEMBL6562094 | 0.68 | PPARD (0.46) | — | |
| SCHEMBL11662609 | 0.67 | — | — | |
| SCHEMBL18097921 | 0.67 | PPARD (0.37) | — | |
| SCHEMBL18686716 | 0.66 | PPARD (0.44) | — | |
| SCHEMBL1291624 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0792146-A1 | INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES | HEMASURE, INC. (US) | 1997-09-03 | — | — | EP | disclosed |
| WO-1997002028-A1 | INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES | HEMASURE, INC. (US) | 1997-01-23 | — | — | WO | disclosed |