⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2697799 | 0.95 | — | — | |
| SCHEMBL4358387 | 0.75 | — | — | |
| SCHEMBL15600536 | 0.67 | — | — | |
| SCHEMBL28783993 | 0.67 | — | — | |
| SCHEMBL11339073 | 0.66 | — | — | |
| SCHEMBL11339070 | 0.66 | — | — | |
| SCHEMBL9420498 | 0.65 | KDM4E (0.36) | — | |
| SCHEMBL11420112 | 0.61 | KDM4E (0.31) | — | |
| SCHEMBL11420108 | 0.61 | KDM4E (0.31) | — | |
| SCHEMBL29666134 | 0.60 | — | — |
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-20030113805-A1 | Intrinsically labelled solid support | ZENECA LIMITED, A LONDON CORPORATION | 2003-06-19 | — | — | US | disclosed |
| US-20010007740-A1 | INTRINSICALLY LABELLED SOLID SUPPORT | ZENECA LTD. | 2001-07-12 | — | — | US | disclosed |
| EP-0843656-A1 | INTRINSICALLY LABELLED SOLID SUPPORT | ZENECA LIMITED (GB) | 1998-05-27 | — | — | EP | disclosed |
| WO-1997003931-A1 | INTRINSICALLY LABELLED SOLID SUPPORT | ZENECA LIMITED (GB) | 1997-02-06 | — | — | WO | disclosed |