⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27590677 | 0.78 | — | — | |
| SCHEMBL3416782 | 0.72 | — | — | |
| SCHEMBL8986509 | 0.68 | — | — | |
| SCHEMBL78094 | 0.64 | — | — | |
| Benzene SCHEMBL9430082 | 0.63 | — | — | |
| SCHEMBL2790799 | 0.63 | KMT2A (0.38) | — | |
| SCHEMBL6505253 | 0.62 | — | — | |
| SCHEMBL27670804 | 0.59 | — | — | |
| SCHEMBL9681384 | 0.58 | — | — | |
| SCHEMBL6227251 | 0.56 | — | — |
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-5141911-A | Bonding to organonitrogen polymer | SOCIETE NATIONALE ELF AQUITAINE (FR) | 1992-08-25 | — | — | US | disclosed |