⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21666 | 0.72 | — | — | |
| SCHEMBL6130676 | 0.72 | — | — | |
| SCHEMBL911109 | 0.72 | — | — | |
| SCHEMBL1681247 | 0.72 | — | — | |
| SCHEMBL28562959 | 0.72 | — | — | |
| SCHEMBL5146 | 0.72 | — | — | |
| SCHEMBL20787031 | 0.67 | — | — | |
| Water SCHEMBL30913054 | 0.67 | — | — | |
| SCHEMBL2875191 | 0.67 | — | — | |
| SCHEMBL20610199 | 0.67 | — | — |
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-20140018463-A1 | MODIFICATION OF BIOMEDICAL POLYMERS FOR PREVENTION OF FOULING AND CLOTTING | ECONOUS SYSTEMS INC. (CA) | 2014-01-16 | — | — | US | disclosed |