⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5616374 | 0.79 | PBRM1 (0.31) | — | |
| SCHEMBL4651065 | 0.79 | CYBB (0.30) | — | |
| SCHEMBL5086293 | 0.78 | BRD4 (0.31) | — | |
| SCHEMBL5354254 | 0.76 | BRD4 (0.30) | — | |
| SCHEMBL5616048 | 0.76 | — | — | |
| SCHEMBL4467659 | 0.75 | MAPT (0.33) | — | |
| Hydrochloric Acid SCHEMBL5614227 | 0.74 | — | — | |
| SCHEMBL1453383 | 0.74 | — | — | |
| SCHEMBL1452990 | 0.74 | — | — | |
| SCHEMBL7202455 | 0.73 | — | — |
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-1866322-A2 | PROCESS FOR PRODUCING SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | ExxonMobil Chemical Patents Inc. (US) | 2007-12-19 | — | — | EP | disclosed |
| WO-2006065844-A2 | PROCESS FOR PRODUCING SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-06-22 | — | — | WO | disclosed |