⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1683997 | 0.87 | — | — | |
| SCHEMBL9813348 | 0.80 | — | — | |
| SCHEMBL10379453 | 0.80 | — | — | |
| SCHEMBL3421438 | 0.78 | — | — | |
| SCHEMBL2801756 | 0.78 | — | — | |
| SCHEMBL12169570 | 0.77 | — | — | |
| SCHEMBL10336746 | 0.75 | — | — | |
| SCHEMBL8419028 | 0.73 | — | — | |
| SCHEMBL10378545 | 0.73 | — | — | |
| SCHEMBL10379851 | 0.73 | LMNA (0.30) | — |
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-0436669-A1 | PERFLUOROACETAL AND PERFLUOROKETAL COMPOUNDS AND USE THEREOF IN THERMAL SHOCK TESTING | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1991-07-17 | — | — | EP | claimed |
| WO-1990003357-A1 | PERFLUOROACETAL AND PERFLUOROKETAL COMPOUNDS AND USE THEREOF IN THERMAL SHOCK TESTING | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1990-04-05 | — | — | WO | claimed |