⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15372547 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL18633958 | 0.79 | — | — | |
| SCHEMBL16203293 | 0.78 | — | — | |
| SCHEMBL21806635 | 0.77 | — | — | |
| SCHEMBL18899564 | 0.76 | — | — | |
| SCHEMBL16926676 | 0.76 | — | — | |
| SCHEMBL15892764 | 0.76 | — | — | |
| SCHEMBL27834582 | 0.74 | FDPS (0.31) | — | |
| SCHEMBL15591882 | 0.74 | ALDH1A1 (0.37) | — | |
| SCHEMBL26033003 | 0.72 | MGMT (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115850945-A | Preparation method of sulfydryl functionalized graphene oxide/BAMO-AMMO-ETPE compound | 西安近代化学研究所 | 2023-03-28 | — | — | CN | claimed |
| CN-115850945-A | Preparation method of sulfydryl functionalized graphene oxide/BAMO-AMMO-ETPE compound | 西安近代化学研究所 | 2023-03-28 | — | — | CN | disclosed |
| CN-115784822-A | Preparation method of amino functionalized graphene oxide/BAMO-AMMO-ETPE compound | 西安近代化学研究所 | 2023-03-14 | — | — | CN | disclosed |