⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2378845 | 0.69 | — | — | |
| SCHEMBL2406439 | 0.67 | ALDH1A1 (0.36) | — | |
| SCHEMBL3413925 | 0.65 | — | — | |
| SCHEMBL12447513 | 0.65 | — | — | |
| SCHEMBL2389184 | 0.65 | — | — | |
| SCHEMBL1005520 | 0.64 | ALDH1A1 (0.42) | — | |
| SCHEMBL2389454 | 0.63 | — | — | |
| SCHEMBL2405658 | 0.62 | — | — | |
| SCHEMBL10490396 | 0.62 | — | — | |
| SCHEMBL1284754 | 0.61 | — | — |
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-20110224340-A1 | Method for Producing Mono-Vinylfunctionalized Dialkylphosphinic Acids, Salts and Esters Thereof, and the Use Thereof | CLARIANT FINANCE (BVI) LIMITED (VG) | 2011-09-15 | — | — | US | disclosed |