⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6511999 | 0.82 | KMT2A (0.38) | — | |
| SCHEMBL762991 | 0.71 | — | — | |
| SCHEMBL7769976 | 0.71 | — | — | |
| SCHEMBL31060847 | 0.71 | — | — | |
| SCHEMBL11261345 | 0.71 | MAPK1 (0.40) | — | |
| SCHEMBL10101916 | 0.67 | — | — | |
| SCHEMBL11361526 | 0.67 | MEN1 (0.37) | — | |
| SCHEMBL2120687 | 0.66 | MEN1 (0.37) | — | |
| SCHEMBL11359705 | 0.66 | NPC1 (0.31) | — | |
| SCHEMBL18173899 | 0.66 | NPC1 (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4406897-A | 6-Aryl-4-hydrazinyl-s-triazin-2-ones | WILLIAM H. RORER, INC. (US) | 1983-09-27 | — | — | US | disclosed |