⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9739 | 0.87 | — | — | |
| SCHEMBL1133910 | 0.87 | — | — | |
| SCHEMBL11439016 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL10393508 | 0.80 | — | — | |
| Charcoal, Activated SCHEMBL8350759 | 0.80 | — | — | |
| Methylene Chloride SCHEMBL8596594 | 0.71 | — | — | |
| Dichlorodifluoromethane SCHEMBL9111076 | 0.67 | — | — | |
| SCHEMBL5829999 | 0.67 | — | — | |
| SCHEMBL11527722 | 0.67 | — | — | |
| SCHEMBL5382623 | 0.63 | — | — |
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-5547593-A | MISCIBILITY WITH REFRIGERANTS | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1996-08-20 | — | — | US | disclosed |