⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL116567 | 0.78 | — | — | |
| Iodide SCHEMBL1568045 | 0.75 | TSHR (0.31) | — | |
| SCHEMBL11793390 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL8098574 | 0.75 | TSHR (0.31) | — | |
| Hydrochloric Acid SCHEMBL21700 | 0.75 | TSHR (0.31) | — | |
| Hydrochloric Acid SCHEMBL6677623 | 0.75 | TSHR (0.31) | — | |
| Methane SCHEMBL6236341 | 0.75 | TSHR (0.31) | — | |
| SCHEMBL334 | 0.75 | — | — | |
| Charcoal, Activated SCHEMBL6236339 | 0.75 | TSHR (0.31) | — | |
| Water SCHEMBL486831 | 0.75 | TSHR (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6787617-B1 | FORMING NARROW MOLECULAR WEIGHT HOMOPOLYMERS AS INTERMEDIATES TO BLOCK OR TERMINAL FUNCTIONALIZED POLYMERS; HAFNIUM OR ZIRCONIUM CYCLOPENTADIENYL FUNCTIONALIZED CATALYSTS WITH TRIPHENYLBORON AND TRIALKYLALUMINUM COMPOUNDS | JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF THE AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2004-09-07 | — | — | US | disclosed |
| EP-1209171-A1 | PROCESS FOR PRODUCING OLEFIN LIVING POLYMER | JAPAN as Represented by DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2002-05-29 | — | — | EP | disclosed |
| US-6271164-B1 | METALLOCENE CATALYST | LYONDELL CHEMICAL TECHNOLOGY, L.P. | 2001-08-07 | — | — | US | disclosed |
| US-6124231-A | Supported catalyst system, processes for its preparation, and its use for the polymerization of olefins | TARGOR GMBH (DE) | 2000-09-26 | — | — | US | disclosed |