⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6422830 | 0.84 | — | — | |
| SCHEMBL14484173 | 0.77 | — | — | |
| SCHEMBL1426645 | 0.56 | — | — | |
| SCHEMBL22953329 | 0.56 | — | — | |
| Propionaldehyde SCHEMBL4301446 | 0.55 | — | — | |
| Butane SCHEMBL3850680 | 0.55 | — | — | |
| Propionaldehyde SCHEMBL10639785 | 0.53 | — | — | |
| SCHEMBL6948531 | 0.53 | — | — | |
| Propionaldehyde SCHEMBL8638106 | 0.53 | — | — | |
| Alcohol SCHEMBL2397925 | 0.53 | — | — |
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-2284212-A1 | PROCESS FOR PRODUCING POLYMER ALLOY AND POLYMER ALLOY | Sekisui Chemical Co., Ltd. (JP) | 2011-02-16 | — | — | EP | disclosed |