⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6377531 | 0.79 | CYP2C19 (0.38) | — | |
| SCHEMBL814934 | 0.76 | — | — | |
| SCHEMBL18288738 | 0.76 | CYP2C19 (0.36) | — | |
| SCHEMBL31350266 | 0.76 | MEN1 (0.39) | — | |
| SCHEMBL1568160 | 0.72 | — | — | |
| SCHEMBL7078217 | 0.72 | — | — | |
| SCHEMBL15119469 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL29249765 | 0.72 | — | — | |
| SCHEMBL12317179 | 0.71 | THRB (0.33) | — | |
| SCHEMBL19426799 | 0.70 | MEN1 (0.58) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100463952-C | Triazine ring combustion inhibitor containing phosphorus and its preparing process | UNIV SOUTH CHINA TECH (CN) | 2009-02-25 | — | — | CN | claimed |
| CN-101007953-A | Triazine ring combustion inhibitor containing phosphorus and its preparing process | UNIV SOUTH CHINA TECH (CN) | 2007-08-01 | — | — | CN | claimed |
| CN-100463952-C | Triazine ring combustion inhibitor containing phosphorus and its preparing process | UNIV SOUTH CHINA TECH (CN) | 2009-02-25 | — | — | CN | disclosed |
| CN-101007953-A | Triazine ring combustion inhibitor containing phosphorus and its preparing process | UNIV SOUTH CHINA TECH (CN) | 2007-08-01 | — | — | CN | disclosed |