⚠ 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 | |
|---|---|---|---|---|
| Methylene Chloride SCHEMBL1154217 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL8546647 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL493 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL7293016 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL1332597 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL18247337 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL434537 | 0.80 | — | — | |
| Methylene Chloride SCHEMBL7299292 | 0.80 | — | — | |
| Methylene Chloride SCHEMBL21625625 | 0.80 | — | — | |
| Methylene Chloride SCHEMBL20539491 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108503652-A | A kind of fully synthetic preparation method of chemistry of crotons alkane diterpene Prostratin | 西安交通大学 | 2018-09-07 | — | — | CN | disclosed |