⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3692806 | 0.86 | — | — | |
| SCHEMBL8161010 | 0.82 | — | — | |
| SCHEMBL688687 | 0.82 | — | — | |
| Ethylene SCHEMBL23301196 | 0.79 | — | — | |
| SCHEMBL21403457 | 0.77 | — | — | |
| SCHEMBL8927134 | 0.76 | — | — | |
| SCHEMBL21980356 | 0.76 | — | — | |
| SCHEMBL630669 | 0.76 | — | — | |
| SCHEMBL6294240 | 0.76 | — | — | |
| SCHEMBL6659310 | 0.76 | CYP19A1 (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0645401-B1 | Process for producing polyolefins | BASELL POLYOLEFINE GMBH (DE) | 2001-12-05 | — | — | EP | claimed |
| US-6417302-B1 | REACTION PRODUCT OF DI(PENTAFLUOROPHENYL) BORINIC ACID AND ORGANOALUMINUM COMPOUND; OLEFIN POLYMERIZATION COORDINATION CATALYSTS | BASELL POLYOLEFINE GMBH (DE) | 2002-07-09 | — | — | US | disclosed |
| EP-1025137-B1 | PHOTO-POLYMERIZATION OF VINYL CHLORIDE USING METALLOCENE CATALYSTS | OXY VINYLS LP (US) | 2001-09-26 | — | — | EP | disclosed |
| US-RE37384-E1 | 2-substituted disindenylmetallocenes, process for their preparation, and their use as catalysts in the polymerization of olefins | TARGOR GMBH (DE) | 2001-09-18 | — | — | US | disclosed |
| US-6025407-A | ALKYL GROUP ON SAID ALUMINUM-CONTAINING COCATALYST IS TRANSFERRED TO SAID POLYVINYL CHLORIDE | OCCIDENTAL CHEMICAL CORPORATION (US) | 2000-02-15 | — | — | US | disclosed |