⚠ 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 | |
|---|---|---|---|---|
| Butane SCHEMBL28786322 | 0.93 | — | — | |
| Butane SCHEMBL1019190 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL8454628 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL1019191 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL5865596 | 0.93 | — | — | |
| Butane SCHEMBL11764235 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL1003138 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL4387446 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL7457770 | 0.93 | TSHR (0.44) | — | |
| Butane SCHEMBL7724220 | 0.93 | TSHR (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0246414-B1 | METHOD OF SUPPRESSING SODIUM POISONING OF CRACKING CATALYSTS DURING FLUID CATALYTIC CRACKING | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-06-26 | — | — | EP | disclosed |
| US-4889617-A | PASSIVATION WITH TIN OR TIN COMPOUNDS | CHEVRON RESEARCH COMPANY (US) | 1989-12-26 | — | — | US | disclosed |
| EP-0246414-A1 | Method of suppressing sodium poisoning of cracking catalysts during fluid catalytic cracking | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1987-11-25 | — | — | EP | disclosed |