⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7109289 | 0.83 | — | — | |
| SCHEMBL7104601 | 0.76 | FYN (0.30) | — | |
| SCHEMBL7662797 | 0.75 | NPC1 (0.31) | — | |
| SCHEMBL7108473 | 0.74 | — | — | |
| SCHEMBL7107159 | 0.72 | LMNA (0.31) | — | |
| SCHEMBL7109071 | 0.72 | LMNA (0.31) | — | |
| SCHEMBL7109077 | 0.72 | LMNA (0.31) | — | |
| SCHEMBL9005173 | 0.70 | MGAM (0.33) | — | |
| SCHEMBL13515750 | 0.70 | MBOAT4 (0.37) | — | |
| SCHEMBL13515763 | 0.70 | CYP11B1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1001944-B1 | PYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | AVENTIS PHARMA SA (FR) | 2003-10-01 | — | — | EP | claimed |
| US-6399613-B1 | N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES | AVENTIS PHARMA S.A. (FR) | 2002-06-04 | — | — | US | claimed |
| US-6399613-B1 | N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES | AVENTIS PHARMA S.A. (FR) | 2002-06-04 | — | — | US | disclosed |