⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1496478 | 0.82 | GLRA1 (0.47) | — | |
| SCHEMBL31258772 | 0.82 | GLRA1 (0.47) | — | |
| SCHEMBL13018317 | 0.82 | — | — | |
| Glycine SCHEMBL6871848 | 0.79 | — | — | |
| SCHEMBL6666101 | 0.79 | — | — | |
| SCHEMBL10041238 | 0.79 | — | — | |
| Glycine SCHEMBL2839436 | 0.79 | — | — | |
| Glycine SCHEMBL22442577 | 0.79 | — | — | |
| Glycine SCHEMBL3941224 | 0.79 | CA4 (0.44) | — | |
| Glycine SCHEMBL5943682 | 0.79 | CA4 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005037797-A1 | SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2005-04-28 | — | — | WO | claimed |
| US-20230330258-A1 | CONJUGATES COMPRISING A PHOSPHORUS (V) AND A DRUG MOIETY | TUBULIS GMBH (DE) | 2023-10-19 | — | — | US | disclosed |
| EP-1996609-B1 | METHOD OF PREPARING GLYCOPEPTIDES | SCRIPPS RESEARCH INST (US) | 2016-08-03 | — | — | EP | disclosed |
| US-8816050-B2 | Method of preparing glycopeptides | THE SCRIPPS RESEARCH INSTITUTE | 2014-08-26 | — | — | US | disclosed |