⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2292521 | 0.83 | — | — | |
| SCHEMBL1224496 | 0.81 | — | — | |
| SCHEMBL2289894 | 0.77 | — | — | |
| SCHEMBL4394393 | 0.72 | — | — | |
| SCHEMBL2292610 | 0.70 | — | — | |
| SCHEMBL790047 | 0.70 | EBP (0.30) | — | |
| SCHEMBL4476459 | 0.69 | — | — | |
| SCHEMBL11597392 | 0.69 | — | — | |
| SCHEMBL8837322 | 0.68 | — | — | |
| SCHEMBL28390688 | 0.67 | — | — |
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-0224264-B1 | USE OF MOISTURE RESISTANT POLYURETHANES DERIVED FROM NON-AROMATIC DIISOCYANATESFOR MEDICAL APPLICATIONS | DOW CORNING CORPORATION (US) | 1991-08-14 | — | — | EP | disclosed |