⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9549412 | 0.63 | — | — | |
| SCHEMBL23346903 | 0.58 | — | — | |
| SCHEMBL9204747 | 0.57 | — | — | |
| SCHEMBL5944764 | 0.43 | — | — | |
| SCHEMBL4216460 | 0.43 | — | — | |
| SCHEMBL9673094 | 0.41 | — | — | |
| SCHEMBL23234265 | 0.41 | MEN1 (0.41) | — | |
| SCHEMBL1042486 | 0.41 | — | — | |
| SCHEMBL10993767 | 0.41 | — | — | |
| Water SCHEMBL8875322 | 0.38 | — | — |
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-2376219-A1 | METHOD FOR CONTROLLING WATER EVAPORATION | Polymers CRC Limited (AU) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010071931-A1 | METHOD FOR CONTROLLING WATER EVAPORATION | POLYMERS CRC LTD (AU) | 2010-07-01 | — | — | WO | disclosed |