⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18420755 | 0.91 | TRPV1 (0.31) | — | |
| SCHEMBL18420601 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL18689998 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL20550131 | 0.87 | — | — | |
| SCHEMBL6231436 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL18689957 | 0.86 | HSP90AA1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL18420190 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL5079593 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL18690029 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL18689947 | 0.85 | MPL (0.35) | — |
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-1296991-B1 | SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEM PATENTS INC (US) | 2013-05-15 | — | — | EP | disclosed |
| EP-1297027-A1 | SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION | Exxonmobil Chemical Patents Inc. (US) | 2003-04-02 | — | — | EP | disclosed |
| WO-2002000738-A1 | SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-01-03 | — | — | WO | disclosed |