⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9797594 | 0.87 | — | — | |
| SCHEMBL9797125 | 0.84 | — | — | |
| SCHEMBL9797155 | 0.83 | — | — | |
| SCHEMBL1594229 | 0.80 | — | — | |
| SCHEMBL620509 | 0.79 | — | — | |
| SCHEMBL17300585 | 0.78 | — | — | |
| SCHEMBL1095729 | 0.78 | LMNA (0.33) | — | |
| SCHEMBL9797138 | 0.76 | — | — | |
| SCHEMBL31197063 | 0.75 | — | — | |
| SCHEMBL18113202 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5075509-A | Lubricants, heat exchangers, vapor phase soldering fluids, solvents, oxygen carrier | EXFLUOR RESEARCH CORPORATION (US) | 1991-12-24 | — | — | US | disclosed |
| EP-0378574-A1 | FLUORINATION OF ORTHOCARBONATES AND POLYALKOXYPROPANES | EXFLUOR RESEARCH CORPORATION (US) | 1990-07-25 | — | — | EP | disclosed |
| WO-1989001929-A2 | FLUORINATION OF ORTHOCARBONATES AND POLYALKOXYPROPANES | EXFLUOR RESEARCH CORPORATION (US) | 1989-03-09 | — | — | WO | disclosed |