⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6429669 | 0.88 | MEN1 (0.34) | — | |
| SCHEMBL5550424 | 0.83 | MEN1 (0.32) | — | |
| SCHEMBL5549892 | 0.78 | GALR1 (0.44) | — | |
| SCHEMBL6612957 | 0.76 | HTR2A (0.38) | — | |
| SCHEMBL6231144 | 0.74 | SIGMAR1 (0.31) | — | |
| SCHEMBL5033937 | 0.73 | GALR1 (0.34) | — | |
| SCHEMBL6427921 | 0.70 | — | — | |
| SCHEMBL6268764 | 0.70 | GALR1 (0.40) | — | |
| SCHEMBL6607370 | 0.69 | GALR1 (0.39) | — | |
| SCHEMBL5554034 | 0.68 | GALR1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1560817-A1 | METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS | Reddy US Therapeutics, Inc. (US) | 2005-08-10 | — | — | EP | claimed |
| WO-2004026844-A1 | METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS | REDDY US THERAPEUTICS, INC. (US) | 2004-04-01 | — | — | WO | claimed |