⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28548292 | 0.97 | — | — | |
| SCHEMBL17336119 | 0.82 | — | — | |
| SCHEMBL11056001 | 0.82 | — | — | |
| SCHEMBL25831983 | 0.78 | — | — | |
| SCHEMBL10314789 | 0.76 | INPP5A (0.33) | — | |
| SCHEMBL16411427 | 0.75 | — | — | |
| SCHEMBL13083291 | 0.73 | — | — | |
| SCHEMBL8380416 | 0.73 | — | — | |
| SCHEMBL14148788 | 0.73 | — | — | |
| SCHEMBL14724502 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9662766-B2 | Method of abrading a workpiece | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2017-05-30 | — | — | US | disclosed |