⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10091811 | 0.94 | — | — | |
| SCHEMBL5888809 | 0.93 | — | — | |
| SCHEMBL13223635 | 0.88 | HPGD (0.33) | — | |
| SCHEMBL10091816 | 0.86 | PLA2G2A (0.33) | — | |
| SCHEMBL19564423 | 0.86 | ALDH1A1 (0.37) | — | |
| SCHEMBL10091820 | 0.84 | BCHE (0.30) | — | |
| SCHEMBL13223618 | 0.83 | HPGD (0.35) | — | |
| SCHEMBL16142529 | 0.83 | — | — | |
| SCHEMBL4187542 | 0.83 | — | — | |
| SCHEMBL12088042 | 0.83 | — | — |
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-8119422-B2 | Stable acridinium esters with fast light emission | SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) | 2012-02-21 | — | — | US | disclosed |
| US-20100099077-A1 | STABLE ACRIDINIUM ESTERS WITH FAST LIGHT EMISSION | SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) | 2010-04-22 | — | — | US | disclosed |