⚠ 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 | |
|---|---|---|---|---|
| Methylpiperazine SCHEMBL1433029 | 1.00 | — | — | |
| Methylpiperazine SCHEMBL6291774 | 0.97 | — | — | |
| Methylpiperazine SCHEMBL5375084 | 0.97 | — | — | |
| Methylpiperazine SCHEMBL28141471 | 0.97 | — | — | |
| Methylpiperazine SCHEMBL12678259 | 0.96 | — | — | |
| SCHEMBL154155 | 0.96 | PHGDH (0.41) | — | |
| Methylpiperazine SCHEMBL54849 | 0.96 | — | — | |
| Methylpiperazine SCHEMBL1363 | 0.96 | — | — | |
| Methylpiperazine SCHEMBL12678256 | 0.96 | — | — | |
| Methylpiperazine SCHEMBL12678252 | 0.96 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105037689-B | Intrinsic fire retarding epoxide resin of Halogen and preparation method thereof | 四川大学 | 2018-01-30 | — | — | CN | disclosed |
| CN-105037689-A | Halogen-free intrinsic flame retardant epoxy resin and preparing method thereof | UNIV SICHUAN | 2015-11-11 | — | — | CN | disclosed |