⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15367159 | 0.79 | — | — | |
| SCHEMBL3777100 | 0.73 | — | — | |
| SCHEMBL14598229 | 0.70 | — | — | |
| SCHEMBL1758677 | 0.69 | — | — | |
| SCHEMBL18538812 | 0.67 | — | — | |
| SCHEMBL20678518 | 0.66 | — | — | |
| SCHEMBL21899301 | 0.65 | — | — | |
| SCHEMBL21633696 | 0.65 | — | — | |
| SCHEMBL7148647 | 0.65 | — | — | |
| SCHEMBL5636385 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4236975-A | AZEOTROPES | PHILLIPS PETROLEUM COMPANY (US) | 1980-12-02 | — | — | US | disclosed |
| US-4229263-A | AZEOTROPES | PHILLIPS PETROLEUM COMPANY (US) | 1980-10-21 | — | — | US | disclosed |
| US-4224112-A | Recovery of 1,1-dihydroheptafluorobutanol from water by distillation | PHILLIPS PETROLEUM COMPANY (US) | 1980-09-23 | — | — | US | disclosed |
| US-4189615-A | RELFUXING | PHILLIPS PETROLEUM COMPANY (US) | 1980-02-19 | — | — | US | disclosed |
| US-4156791-A | Preparation of alcohols by treating esters with alkali metal borohydride | PHILLIPS PETROLEUM COMPANY (US) | 1979-05-29 | — | — | US | disclosed |