⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL236806 | 0.70 | — | — | |
| SCHEMBL8096520 | 0.63 | — | — | |
| SCHEMBL8093066 | 0.62 | — | — | |
| SCHEMBL9064169 | 0.60 | — | — | |
| SCHEMBL11527926 | 0.60 | — | — | |
| SCHEMBL27493884 | 0.58 | — | — | |
| SCHEMBL7029001 | 0.58 | — | — | |
| SCHEMBL28635962 | 0.58 | — | — | |
| SCHEMBL11789842 | 0.57 | CES2 (0.38) | — | |
| SCHEMBL5349797 | 0.57 | CES2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100197836-A1 | Metal Rich Coatings Compositions | UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY | 2010-08-05 | — | — | US | disclosed |