⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL572817 | 0.79 | OR51E2 (0.50) | — | |
| SCHEMBL93977 | 0.79 | OR51E2 (0.50) | — | |
| Alcohol SCHEMBL6238241 | 0.78 | OR51E2 (0.43) | — | |
| SCHEMBL28462276 | 0.78 | — | — | |
| SCHEMBL6249794 | 0.77 | OR51E2 (0.48) | — | |
| Water SCHEMBL22418485 | 0.77 | OR51E2 (0.55) | — | |
| SCHEMBL4985589 | 0.77 | OR51E2 (0.48) | — | |
| SCHEMBL146486 | 0.77 | OR51E2 (0.48) | — | |
| SCHEMBL325990 | 0.76 | GPR84 (0.38) | — | |
| SCHEMBL9235825 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102099186-A | Biolaminate composite assembly and related methods | BIOVATION LLC | 2011-06-15 | — | — | CN | disclosed |
| EP-1166283-B1 | COATING COMPOSITION FOR METALLIC CONDUCTORS AND COATING METHOD USING SAME | DU PONT (US) | 2003-10-15 | — | — | EP | disclosed |
| EP-1166283-A1 | COATING COMPOSITION FOR METALLIC CONDUCTORS AND COATING METHOD USING SAME | E.I. DU PONT DE NEMOURS & COMPANY INCORPORATED (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000054286-A1 | COATING COMPOSITION FOR METALLIC CONDUCTORS AND COATING METHOD USING SAME | E.I. DU PONT DE NEMOURS AND COMPANY, INC. (US) | 2000-09-14 | — | — | WO | disclosed |