⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27866692 | 0.78 | — | — | |
| SCHEMBL415767 | 0.69 | — | — | |
| SCHEMBL106259 | 0.69 | — | — | |
| SCHEMBL24959 | 0.69 | — | — | |
| SCHEMBL3481852 | 0.69 | — | — | |
| SCHEMBL138265 | 0.67 | — | — | |
| SCHEMBL9224627 | 0.67 | — | — | |
| SCHEMBL3890552 | 0.67 | — | — | |
| SCHEMBL704746 | 0.67 | — | — | |
| SCHEMBL8852221 | 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-20190169445-A1 | SURFACE-TREATING AGENT AND ARTICLE COMPRISING LAYER FORMED FROM SURFACE-TREATING AGENT | DAIKIN INDUSTRIES, LTD. (JP) | 2019-06-06 | — | — | US | disclosed |