⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6546928 | 0.73 | CHRM2 (0.30) | — | |
| SCHEMBL6456571 | 0.69 | — | — | |
| SCHEMBL6455046 | 0.63 | — | — | |
| SCHEMBL13600314 | 0.51 | TDP1 (0.45) | — | |
| SCHEMBL11928939 | 0.49 | NQO1 (0.48) | — | |
| SCHEMBL5039621 | 0.49 | NQO1 (0.47) | — | |
| SCHEMBL13672157 | 0.46 | NQO1 (0.38) | — | |
| SCHEMBL182910 | 0.46 | — | — | |
| SCHEMBL9586 | 0.46 | — | — | |
| SCHEMBL15918971 | 0.46 | CA1 (0.43) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6949614-B1 | Catalyst system | BASELL POLYOLEFINE GMBH (DE) | 2005-09-27 | — | — | US | disclosed |
| EP-1175262-B1 | CATALYST SYSTEM | BASELL POLYOLEFINE GMBH (DE) | 2004-02-18 | — | — | EP | disclosed |
| EP-1290002-B1 | CHEMICAL PRODUCTS SUITED FOR USE AS CO-CATALYSTS, METHOD FOR THE PREPARATION THEREOF AND THEIR USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS | BASELL POLYOLEFINE GMBH (DE) | 2004-01-21 | — | — | EP | disclosed |
| EP-0812891-B1 | Coatings based on perfluoropolyethers | SOLVAY SOLEXIS SPA (IT) | 2003-10-01 | — | — | EP | disclosed |
| EP-1344807-A2 | Coatings based on perfluoropolyethers | Solvay Solexis S.p.A. (IT) | 2003-09-17 | — | — | EP | disclosed |
| US-6071564-A | COATING AND PROTECTING SUBSTRATES WITH PERFLUOROPOLYETHERAL PREPOLYMERS AND POLYISOCYANATES FOR POLYURETHANES PROTECTIVE COATINGS | AUSIMONT S.P.A. (IT) | 2000-06-06 | — | — | US | disclosed |
| EP-0812891-A2 | Coatings based on perfluoropolyethers | Ausimont S.p.A. (IT) | 1997-12-17 | — | — | EP | disclosed |