⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1128499 | 0.75 | — | — | |
| SCHEMBL31371166 | 0.72 | HTT (0.37) | — | |
| SCHEMBL6839389 | 0.70 | TP53 (0.46) | — | |
| SCHEMBL129645 | 0.68 | PLK4 (0.46) | — | |
| SCHEMBL15397499 | 0.64 | MAPK1 (0.32) | — | |
| SCHEMBL1019059 | 0.64 | ADORA2A (0.42) | — | |
| SCHEMBL11165369 | 0.63 | L3MBTL1 (0.56) | — | |
| SCHEMBL11163491 | 0.61 | KDM4E (0.32) | — | |
| SCHEMBL20589660 | 0.61 | KMT2A (0.45) | — | |
| SCHEMBL24009699 | 0.60 | MEN1 (0.33) | — |
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-1993018035-A1 | ANGIOTENSIN II RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 1993-09-16 | — | — | WO | disclosed |