Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL5603568 | 0.75 | — | — | |
| SCHEMBL5600304 | 0.75 | MCHR2 (0.33) | — | |
| SCHEMBL5600446 | 0.74 | SLC6A2 (0.30) | — | |
| SCHEMBL6445115 | 0.74 | CDK4 (0.40) | CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5604171 | 0.72 | CDK4 (0.39) | CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5604161 | 0.72 | CDK4 (0.32) | CDK4CCND1 | |
| SCHEMBL5600041 | 0.70 | OXTR (0.32) | — | |
| SCHEMBL5603359 | 0.69 | KDM4E (0.31) | — | |
| SCHEMBL6064142 | 0.68 | — | — | |
| SCHEMBL5600794 | 0.65 | CA1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | disclosed |
| EP-1735354-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | Exxonmobil Chemical Company Inc. (US) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005105864-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-11-10 | — | — | WO | disclosed |