⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4577383 | 0.91 | — | — | |
| SCHEMBL6066574 | 0.85 | — | — | |
| SCHEMBL4576209 | 0.84 | — | — | |
| SCHEMBL1820106 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL1115877 | 0.82 | — | — | |
| Fluoride SCHEMBL1130891 | 0.82 | — | — | |
| Methoxymethane SCHEMBL28970298 | 0.80 | — | — | |
| SCHEMBL4464406 | 0.77 | ACHE (0.37) | — | |
| SCHEMBL4191895 | 0.76 | — | — | |
| SCHEMBL8779508 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7077977-B2 | Bulky borate activations | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-07-18 | — | — | US | disclosed |
| US-20040254065-A1 | Bulky borate activations | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-12-16 | — | — | US | disclosed |
| EP-1461152-A1 | BULKY BORATE ACTIVATORS | ExxonMobil Chemical Patents Inc. (US) | 2004-09-29 | — | — | EP | disclosed |
| WO-2003049856-A1 | BULKY BORATE ACTIVATORS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2003-06-19 | — | — | WO | disclosed |