⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29624197 | 0.75 | — | — | |
| SCHEMBL7696697 | 0.71 | — | — | |
| SCHEMBL295496 | 0.67 | — | — | |
| SCHEMBL11664578 | 0.67 | — | — | |
| SCHEMBL10723948 | 0.65 | — | — | |
| SCHEMBL10698152 | 0.65 | — | — | |
| SCHEMBL4189801 | 0.63 | — | — | |
| SCHEMBL15738133 | 0.63 | — | — | |
| Isopropylamine SCHEMBL1193775 | 0.61 | — | — | |
| SCHEMBL11772257 | 0.61 | — | — |
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-2002024777-A2 | A PROCESS FOR FORMING A TWO-COAT COMPOSITE COATING, THE COMPOSITE COATING AND CHIP RESISTANT COATING COMPOSITION | PPG INDUSTRIES OHIO, INC. (US) | 2002-03-28 | — | — | WO | disclosed |