⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4869822 | 0.83 | — | — | |
| SCHEMBL4866050 | 0.74 | ALOX15 (0.30) | — | |
| SCHEMBL4864743 | 0.70 | ALOX15 (0.34) | — | |
| SCHEMBL4869807 | 0.69 | FOLH1 (0.38) | — | |
| SCHEMBL11670699 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL4868661 | 0.67 | KIF11 (0.35) | — | |
| SCHEMBL11670327 | 0.66 | NPSR1 (0.33) | — | |
| SCHEMBL4871616 | 0.66 | SLC1A3 (0.39) | — | |
| SCHEMBL4863716 | 0.66 | METAP1 (0.33) | — | |
| SCHEMBL4873572 | 0.65 | FFAR1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-1599487-A1 | PHOSPHINIC ACID ANALOGS OF GLUTAMATE | Givaudan SA (CH) | 2005-11-30 | — | — | EP | disclosed |
| WO-2004043971-A1 | PHOSPHINIC ACID ANALOGS OF GLUTAMATE | GIVAUDAN SA (CH) | 2004-05-27 | — | — | WO | disclosed |