⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL530977 | 0.78 | — | — | |
| SCHEMBL20344873 | 0.75 | — | — | |
| SCHEMBL7158083 | 0.75 | — | — | |
| SCHEMBL23775554 | 0.72 | — | — | |
| SCHEMBL2469469 | 0.72 | — | — | |
| SCHEMBL8235950 | 0.72 | — | — | |
| SCHEMBL10813455 | 0.72 | — | — | |
| SCHEMBL15676 | 0.71 | — | — | |
| SCHEMBL43027 | 0.71 | — | — | |
| SCHEMBL210425 | 0.71 | — | — |
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-4146511-A | Resin compositions for peel-off coatings comprising a film-forming polymeric resin, an organo polysiloxane and a solvent | SHIN-ESTU CHEMICAL CO., LTD. (JP) | 1979-03-27 | — | — | US | disclosed |