⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4874718 | 0.76 | RXRA (0.33) | — | |
| SCHEMBL4872665 | 0.73 | — | — | |
| SCHEMBL3514480 | 0.72 | KMT2A (0.37) | — | |
| SCHEMBL3510332 | 0.71 | RECQL (0.40) | — | |
| SCHEMBL4872670 | 0.68 | KDM4E (0.31) | — | |
| SCHEMBL4871261 | 0.65 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL4872659 | 0.63 | HSD17B10 (0.37) | — | |
| SCHEMBL3516030 | 0.63 | ALDH1A1 (0.38) | — | |
| SCHEMBL27615261 | 0.61 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL4871262 | 0.61 | MEN1 (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7402576-B2 | Phosphinic acid analogs of glutamate | GIVAUDAN SA (CH) | 2008-07-22 | — | — | US | disclosed |
| EP-1599487-B1 | PHOSPHINIC ACID ANALOGS OF GLUTAMATE | GIVAUDAN SA (CH) | 2007-07-11 | — | — | EP | disclosed |
| US-20060052616-A1 | Phosphinic acid analogs of glutamate | GIVAUDAN SA (CH) | 2006-03-09 | — | — | US | disclosed |