⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23308767 | 0.90 | — | — | |
| SCHEMBL22601212 | 0.85 | — | — | |
| SCHEMBL24973953 | 0.82 | RAPGEF4 (0.33) | — | |
| SCHEMBL16707523 | 0.74 | CYP3A4 (0.33) | — | |
| SCHEMBL11415517 | 0.70 | CYP3A4 (0.35) | — | |
| SCHEMBL14016704 | 0.70 | — | — | |
| SCHEMBL14016707 | 0.70 | — | — | |
| SCHEMBL13980077 | 0.69 | CYP3A4 (0.30) | — | |
| SCHEMBL31633792 | 0.69 | CYP3A4 (0.30) | — | |
| SCHEMBL2604714 | 0.69 | CYP3A4 (0.30) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210121863-A1 | Catalyst Systems Including Salan Catalyst and Non-Coordinating Anion Type Activator Containing Cation Having Alkyl Groups and uses Thereof | EXXONMOBIL CHEMICAL PATENTS INC. | 2021-04-29 | — | — | US | disclosed |