⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL455006 | 0.95 | — | — | |
| SCHEMBL13217913 | 0.95 | — | — | |
| SCHEMBL18641286 | 0.90 | — | — | |
| Fluoromethane SCHEMBL18037036 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL29171382 | 0.86 | — | — | |
| SCHEMBL28142522 | 0.82 | TSHR (0.31) | — | |
| SCHEMBL21051170 | 0.79 | — | — | |
| SCHEMBL170892 | 0.70 | — | — | |
| SCHEMBL477963 | 0.70 | — | — | |
| SCHEMBL477890 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1322726-A4 | IMPROVED CATALYTIC REFORMING PROCESS | CONOCOPHILLIPS CO (US) | 2004-09-29 | — | — | EP | disclosed |
| EP-1322726-A1 | IMPROVED CATALYTIC REFORMING PROCESS | ConocoPhillips Company (US) | 2003-07-02 | — | — | EP | disclosed |
| US-6478952-B1 | Catalytic reforming process including the addition of organic aluminum halide | PHILLIPS PETROLEUM COMPANY | 2002-11-12 | — | — | US | disclosed |
| WO-2002006426-A1 | IMPROVED CATALYTIC REFORMING PROCESS | PHILLIPS PETROLEUM COMPANY (US) | 2002-01-24 | — | — | WO | disclosed |