⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7908073 | 0.84 | — | — | |
| SCHEMBL8815883 | 0.84 | — | — | |
| SCHEMBL10923395 | 0.84 | — | — | |
| SCHEMBL11711993 | 0.78 | CYP2C9 (0.31) | — | |
| SCHEMBL342048 | 0.78 | CYP2C9 (0.31) | — | |
| SCHEMBL16976743 | 0.70 | — | — | |
| SCHEMBL16512638 | 0.70 | — | — | |
| SCHEMBL11218562 | 0.67 | — | — | |
| SCHEMBL25093123 | 0.60 | — | — | |
| SCHEMBL1647054 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4814447-A | Preparation of hydroxyalkylpiperazinones by reacting an alkylene oxide with decahydropyrazino[2,3-b]pyrazine or its substituted derivatives | THE DOW CHEMICAL COMPANY (US) | 1989-03-21 | — | — | US | claimed |
| US-4814447-A | Preparation of hydroxyalkylpiperazinones by reacting an alkylene oxide with decahydropyrazino[2,3-b]pyrazine or its substituted derivatives | THE DOW CHEMICAL COMPANY (US) | 1989-03-21 | — | — | US | disclosed |