⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18788393 | 0.67 | — | — | |
| SCHEMBL5172035 | 0.64 | — | — | |
| SCHEMBL28629811 | 0.62 | — | — | |
| SCHEMBL720480 | 0.59 | — | — | |
| SCHEMBL9323148 | 0.59 | — | — | |
| SCHEMBL1006909 | 0.59 | — | — | |
| SCHEMBL2820032 | 0.59 | — | — | |
| SCHEMBL270616 | 0.59 | — | — | |
| SCHEMBL1044261 | 0.59 | — | — | |
| SCHEMBL16694715 | 0.58 | — | — |
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-7101524-B2 | Process for purifying sand | GE BETZ, INC. (US) | 2006-09-05 | — | — | US | disclosed |