⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6434286 | 0.85 | MAP3K7 (0.32) | — | |
| SCHEMBL6434283 | 0.85 | MAP3K7 (0.32) | — | |
| SCHEMBL5542759 | 0.85 | CYP3A4 (0.30) | — | |
| SCHEMBL21357734 | 0.84 | CYP3A4 (0.32) | — | |
| Hydrochloric Acid SCHEMBL28268599 | 0.84 | MAP3K7 (0.31) | — | |
| SCHEMBL4275121 | 0.84 | CYP3A4 (0.33) | — | |
| SCHEMBL430439 | 0.83 | CYP3A4 (0.31) | — | |
| SCHEMBL1161686 | 0.83 | CYP3A4 (0.31) | — | |
| SCHEMBL18633058 | 0.83 | — | — | |
| SCHEMBL6887972 | 0.82 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3353218-A1 | ZIEGLER-NATTA - METALLOCENE DUAL CATALYST SYSTEMS WITH ACTIVATOR-SUPPORTS | Chevron Phillips Chemical Company LP (US) | 2018-08-01 | — | — | EP | disclosed |
| WO-2017053375-A1 | ZIEGLER-NATTA - METALLOCENE DUAL CATALYST SYSTEMS WITH ACTIVATOR-SUPPORTS | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2017-03-30 | — | — | WO | disclosed |