⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6178790 | 0.77 | — | — | |
| SCHEMBL4646387 | 0.77 | — | — | |
| SCHEMBL28149267 | 0.74 | — | — | |
| SCHEMBL29256041 | 0.74 | TSHR (0.55) | — | |
| SCHEMBL480197 | 0.74 | CYP4F2 (0.38) | — | |
| SCHEMBL23874560 | 0.71 | TSHR (0.40) | — | |
| SCHEMBL11128681 | 0.70 | NAALAD2 (0.48) | — | |
| SCHEMBL128632 | 0.70 | — | — | |
| SCHEMBL4648822 | 0.70 | — | — | |
| SCHEMBL8664625 | 0.69 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060148659-A1 | Fracturing fluids containing borate esters as crosslinking agents | B.J. SERVICES COMPANY CANADA (CA) | 2006-07-06 | — | — | US | disclosed |
| CN-1250534-C | Process for the manufacture of hydroxy ester derivative intermediates and epoxy resins prepared therefrom | DOW GLOBAL TECHNOLOGIES COMPAN (US) | 2006-04-12 | — | — | CN | disclosed |
| US-7007757-B2 | Fracturing fluids containing borate esters as crosslinking agents and method of using same | BJ SERVICES COMPANY CANADA (CA) | 2006-03-07 | — | — | US | disclosed |
| CN-1667014-A | Process for manufacturing a hydroxyester derivative intermediate | DOW CHEMICAL CO (US) | 2005-09-14 | — | — | CN | disclosed |
| US-20030234105-A1 | Fracturing fluids containing borate esters as crosslinking agents and method of using same | B.J. SERVICES COMPANY CANADA (CA) | 2003-12-25 | — | — | US | disclosed |
| CN-1439027-A | Process for the manufacture of hydroxy ester derivative intermediates and epoxy resins prepared therefrom | DOW GLOBAL TECHNOLOGIES COMPAN (US) | 2003-08-27 | — | — | CN | disclosed |