⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1031137 | 0.82 | — | — | |
| SCHEMBL10798475 | 0.76 | — | — | |
| SCHEMBL317986 | 0.68 | — | — | |
| SCHEMBL370293 | 0.68 | — | — | |
| SCHEMBL8777519 | 0.67 | — | — | |
| SCHEMBL9421787 | 0.67 | — | — | |
| SCHEMBL49524 | 0.67 | — | — | |
| SCHEMBL28601645 | 0.63 | — | — | |
| SCHEMBL9234557 | 0.60 | — | — | |
| SCHEMBL13279759 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101601103-A | Gaseous Dielectrics with Low Global Warming Potential | HONEYWELL INT INC (US) | 2009-12-09 | — | — | CN | disclosed |