⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2829668 | 0.69 | — | — | |
| SCHEMBL3315004 | 0.65 | — | — | |
| SCHEMBL30686712 | 0.65 | — | — | |
| SCHEMBL9802062 | 0.65 | — | — | |
| SCHEMBL28347370 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL28514848 | 0.62 | — | — | |
| SCHEMBL27065 | 0.62 | — | — | |
| SCHEMBL8323702 | 0.61 | — | — | |
| Ethylene SCHEMBL28365968 | 0.61 | — | — | |
| SCHEMBL6153788 | 0.59 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2220124-A2 | BIOMARKER DETECTION | Ateris Technologies. Llc (US) | 2010-08-25 | — | — | EP | disclosed |
| EP-2092076-A2 | PESTICIDE BIOMARKER | Ateris Technologies, LLC (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2009064321-A2 | BIOMARKER DETECTION | ATERIS TECHNOLOGIES. LLC (US) | 2009-05-22 | — | — | WO | disclosed |
| WO-2008079185-A2 | PESTICIDE BIOMARKER | ATERIS TECHNOLOGIES, LLC (US) | 2008-07-03 | — | — | WO | disclosed |