⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8577434 | 0.86 | MEN1 (0.37) | — | |
| SCHEMBL2338040 | 0.81 | GAA (0.39) | — | |
| SCHEMBL11829370 | 0.74 | — | — | |
| Water SCHEMBL11884534 | 0.72 | — | — | |
| SCHEMBL9067339 | 0.71 | — | — | |
| SCHEMBL7802689 | 0.71 | — | — | |
| SCHEMBL1897647 | 0.69 | — | — | |
| SCHEMBL643456 | 0.69 | — | — | |
| SCHEMBL9009581 | 0.68 | — | — | |
| SCHEMBL31072722 | 0.67 | MAPT (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7655733-B2 | Postcrosslinking of water absorbing polymers with cyclic carbamates and/or cyclic ureas | BASF AKTIENGESELLSCHAFT (DE) | 2010-02-02 | — | — | US | disclosed |
| US-20080171837-A1 | Treating water absorbing polymer with at least one postcrosslinker comprising a cyclic carbamate or a cyclic urea, wherein the cyclic carbamate or urea was obtained by reacting an aminoalcohol or a diamine with a cyclic carbonate; for diapers | BASF AKTIENGESELLSCHAFT (DE) | 2008-07-17 | — | — | US | disclosed |