⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27361102 | 1.00 | — | — | |
| SCHEMBL27364252 | 0.79 | — | — | |
| SCHEMBL27936497 | 0.76 | ATM (0.35) | — | |
| SCHEMBL25289068 | 0.71 | — | — | |
| SCHEMBL9655958 | 0.70 | — | — | |
| SCHEMBL3852439 | 0.68 | ALDH1A1 (0.32) | — | |
| SCHEMBL31534017 | 0.67 | ALDH1A1 (0.41) | — | |
| SCHEMBL2881050 | 0.67 | MAPK1 (0.34) | — | |
| SCHEMBL14828100 | 0.64 | — | — | |
| SCHEMBL15671347 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1070203-C | Process for the polymerization of beta-substituted beta-propiolactones initiated by zinc alkoxyalkyl | PROCTER & GAMBLE (US) | 2001-08-29 | — | — | CN | claimed |
| CN-1139937-A | Polymerization of beta-substituted-beta-propiolactones initiated by alkylzinc alkoxides | PROCTER & GAMBLE (US) | 1997-01-08 | — | — | CN | claimed |