⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5821161 | 0.93 | — | — | |
| SCHEMBL4646 | 0.93 | — | — | |
| Water SCHEMBL1647437 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL634787 | 0.86 | — | — | |
| SCHEMBL15153842 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL6308604 | 0.86 | — | — | |
| SCHEMBL309492 | 0.86 | — | — | |
| Fluoride SCHEMBL11853405 | 0.86 | — | — | |
| SCHEMBL15153745 | 0.86 | — | — | |
| SCHEMBL11030209 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006051932-A1 | LAUNDRY CREAMY SMOOTHNESS IMPROVER | KAO CORPORATION (JP) | 2006-05-18 | — | — | WO | disclosed |