⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL980941 | 0.94 | — | — | |
| SCHEMBL8367454 | 0.94 | — | — | |
| SCHEMBL8508996 | 0.89 | — | — | |
| SCHEMBL3972902 | 0.89 | — | — | |
| SCHEMBL8626696 | 0.89 | — | — | |
| SCHEMBL11356945 | 0.88 | — | — | |
| SCHEMBL876723 | 0.88 | — | — | |
| SCHEMBL17262 | 0.88 | — | — | |
| SCHEMBL8529454 | 0.88 | — | — | |
| SCHEMBL8503530 | 0.88 | — | — |
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-0531364-B1 | LARGE-PORED MOLECULAR SIEVES CONTAINING AT LEAST ONE OCTAHEDRAL SITE AND TETRAHEDRAL SITES OF AT LEAST ONE TYPE | ENGELHARD CORP (US) | 1998-06-17 | — | — | EP | disclosed |
| US-5208006-A | Large-pored molecular sieves containing at least one octahedral site comprising titanium and at least silicon as a tetrahedral site | ENGELHARD CORPORATION (US) | 1993-05-04 | — | — | US | disclosed |
| EP-0531364-A4 | LARGE-PORED MOLECULAR SIEVES CONTAINING AT LEAST ONE OCTAHEDRAL SITE AND TETRAHEDRAL SITES OF AT LEAST ONE TYPE | — | 1993-03-31 | — | — | EP | disclosed |
| EP-0531364-A1 | LARGE-PORED MOLECULAR SIEVES CONTAINING AT LEAST ONE OCTAHEDRAL SITE AND TETRAHEDRAL SITES OF AT LEAST ONE TYPE | ENGELHARD CORPORATION (US) | 1993-03-17 | — | — | EP | disclosed |
| WO-1991018833-A1 | LARGE-PORED MOLECULAR SIEVES CONTAINING AT LEAST ONE OCTAHEDRAL SITE AND TETRAHEDRAL SITES OF AT LEAST ONE TYPE | ENGELHARD CORPORATION (US) | 1991-12-12 | — | — | WO | disclosed |