⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31745592 | 0.67 | — | — | |
| SCHEMBL10954159 | 0.65 | TP53 (0.32) | — | |
| SCHEMBL23803165 | 0.64 | — | — | |
| Ethylbenzene SCHEMBL20979813 | 0.62 | — | — | |
| SCHEMBL30991679 | 0.61 | HPGD (0.32) | — | |
| SCHEMBL337074 | 0.59 | — | — | |
| SCHEMBL439074 | 0.48 | PTGS2 (0.48) | — | |
| Magnesium SCHEMBL31011245 | 0.48 | — | — | |
| SCHEMBL1004361 | 0.47 | — | — | |
| SCHEMBL23202780 | 0.46 | PTGS2 (0.46) | — |
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-20250023061-A1 | METHOD FOR THE SYNTHESIS OF A METAL CATALYST SURROUNDED WITH A CARBON MATRIX | UNIVERSITE SAVOIE MONT BLANC (FR) | 2025-01-16 | — | — | US | disclosed |