⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6370939 | 0.74 | — | — | |
| SCHEMBL9161862 | 0.71 | — | — | |
| SCHEMBL2286726 | 0.69 | — | — | |
| SCHEMBL1556962 | 0.68 | — | — | |
| SCHEMBL9724513 | 0.64 | — | — | |
| SCHEMBL10576317 | 0.61 | — | — | |
| SCHEMBL22028086 | 0.61 | — | — | |
| SCHEMBL21052401 | 0.61 | — | — | |
| SCHEMBL6364934 | 0.61 | — | — | |
| SCHEMBL16234265 | 0.61 | — | — |
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-8178354-B2 | Chemical sensors comprising fluorescent conjugated polymers as sensitive materials, and their use in the detection or assaying of nitro compounds | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2012-05-15 | — | — | US | disclosed |
| US-20080044910-A1 | Chemical Sensors Comprising Fluorescent Conjugated Polymers as Sensitive Materials, and Their use in the Detection or Assaying of Nitro Compounds | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2008-02-21 | — | — | US | disclosed |