⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL243233 | 0.93 | — | — | |
| SCHEMBL1908494 | 0.93 | — | — | |
| SCHEMBL55 | 0.93 | — | — | |
| Charcoal, Activated SCHEMBL9804777 | 0.86 | — | — | |
| SCHEMBL15841463 | 0.86 | — | — | |
| SCHEMBL7071040 | 0.86 | — | — | |
| Ethylene SCHEMBL905584 | 0.86 | — | — | |
| SCHEMBL10617974 | 0.86 | — | — | |
| Fluoride SCHEMBL9374351 | 0.86 | — | — | |
| Fluoride SCHEMBL424665 | 0.86 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7678209-B2 | Energy-producing material | DIEHL BGT DEFENCE GMBH & CO., KG (DE) | 2010-03-16 | — | — | US | disclosed |
| US-20100036086-A1 | ENERGY-PRODUCING MATERIAL | DIEHL BGT DEFENCE GMBH & CO., KG (DE) | 2010-02-11 | — | — | US | disclosed |