⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4490802 | 0.81 | — | — | |
| SCHEMBL4481449 | 0.76 | MAPK1 (0.40) | — | |
| SCHEMBL6623337 | 0.75 | HPGD (0.45) | — | |
| SCHEMBL4355673 | 0.75 | POLB (0.51) | — | |
| SCHEMBL1422592 | 0.73 | — | — | |
| SCHEMBL855237 | 0.73 | — | — | |
| SCHEMBL512220 | 0.72 | — | — | |
| SCHEMBL6764380 | 0.71 | POLB (0.45) | — | |
| SCHEMBL6624469 | 0.69 | GAA (0.40) | — | |
| SCHEMBL28879753 | 0.69 | HDAC1 (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007017728-A2 | NOVEL HETEROCYCLIC COMPOUNDS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-02-15 | — | — | WO | claimed |