⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16688403 | 0.85 | S100A4 (0.32) | — | |
| SCHEMBL14049955 | 0.76 | PRMT6 (0.45) | — | |
| SCHEMBL23665620 | 0.74 | PRMT6 (0.58) | — | |
| SCHEMBL10017405 | 0.74 | PRMT6 (0.65) | — | |
| SCHEMBL96145 | 0.72 | — | — | |
| SCHEMBL19236835 | 0.71 | DPP4 (0.43) | — | |
| SCHEMBL1523312 | 0.70 | — | — | |
| SCHEMBL128771 | 0.70 | — | — | |
| SCHEMBL126278 | 0.70 | — | — | |
| SCHEMBL1768938 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020167799-A1 | SUPPORTED TRANSITION METAL BIS (PHENOLATE) COMPLEXES AND THEIR USE AS CATALYSTS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2020-08-20 | — | — | WO | disclosed |