⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4602497 | 0.75 | — | — | |
| SCHEMBL4039306 | 0.73 | — | — | |
| SCHEMBL1287872 | 0.73 | — | — | |
| SCHEMBL7896783 | 0.71 | — | — | |
| SCHEMBL19170044 | 0.69 | — | — | |
| SCHEMBL18884459 | 0.69 | — | — | |
| SCHEMBL18878213 | 0.69 | — | — | |
| SCHEMBL19170061 | 0.67 | — | — | |
| SCHEMBL10420230 | 0.67 | — | — | |
| SCHEMBL19169970 | 0.66 | — | — |
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-20170210916-A1 | SURFACE COATING MATERIAL, COATING FILM, AND HYDROPHILIC OIL REPELLENT MEMBER | MITSUBISHI MATERIALS CORPORATION (JP) | 2017-07-27 | — | — | US | disclosed |