⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8776682 | 0.84 | — | — | |
| SCHEMBL28799206 | 0.81 | — | — | |
| SCHEMBL9504376 | 0.76 | — | — | |
| SCHEMBL273280 | 0.74 | — | — | |
| SCHEMBL8039667 | 0.71 | — | — | |
| SCHEMBL28127985 | 0.69 | — | — | |
| SCHEMBL3975507 | 0.67 | — | — | |
| SCHEMBL12715656 | 0.67 | — | — | |
| SCHEMBL11399545 | 0.66 | ALDH1A1 (0.30) | — | |
| SCHEMBL598447 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4784673-A | DIS-HYDROXYMETHYL DIOXANE | SHELL OIL COMPANY (US) | 1988-11-15 | — | — | US | claimed |
| US-5673753-A | IN-SITU CEMENTATION BY ADDITION OF BLAST FURNACE SLAG | SHELL OIL COMPANY (US) | 1997-10-07 | — | — | US | disclosed |
| US-5423379-A | Method for drilling and cementing a well | SHELL OIL COMPANY (US) | 1995-06-13 | — | — | US | disclosed |
| US-5260269-A | Used for oil and gas wells additives controls fluid flow | SHELL OIL COMPANY (US) | 1993-11-09 | — | — | US | disclosed |
| US-5248665-A | Low temperature additive, polymers of dimerized glycerol, bis(hydroxymethyl) 1,4-dioxane monomer | SHELL OIL COMPANY (US) | 1993-09-28 | — | — | US | disclosed |
| US-5198416-A | Polyglycerols | SHELL OIL COMPANY (US) | 1993-03-30 | — | — | US | disclosed |
| US-5085282-A | Enhancing oil in water wmulsions by incorporating alcohol | SHELL OIL COMPANY (US) | 1992-02-04 | — | — | US | disclosed |
| US-5083622-A | Using cyclicetherpolyol | SHELL OIL COMPANY (US) | 1992-01-28 | — | — | US | disclosed |
| US-5076364-A | Injecting carrier and alcohol | SHELL OIL COMPANY (US) | 1991-12-31 | — | — | US | disclosed |
| US-5076373-A | Alcohol and hydrolyzed polyacrylamide | SHELL OIL COMPANY (US) | 1991-12-31 | — | — | US | disclosed |
| US-5072794-A | Circulating water-free drilling fluid containing polyol or cyclic ether polyol | SHELL OIL COMPANY (US) | 1991-12-17 | — | — | US | disclosed |
| US-5058679-A | Adding blast furnace slag | SHELL OIL COMPANY (US) | 1991-10-22 | — | — | US | disclosed |
| US-4784673-A | DIS-HYDROXYMETHYL DIOXANE | SHELL OIL COMPANY (US) | 1988-11-15 | — | — | US | disclosed |
| US-4784673-A | DIS-HYDROXYMETHYL DIOXANE | SHELL OIL COMPANY (US) | 1988-11-15 | — | — | US | disclosed |