⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15796098 | 0.76 | OPRM1 (0.32) | — | |
| SCHEMBL14910753 | 0.76 | — | — | |
| SCHEMBL22733964 | 0.72 | — | — | |
| SCHEMBL15795898 | 0.72 | — | — | |
| SCHEMBL15795366 | 0.72 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL15795970 | 0.71 | — | — | |
| SCHEMBL15795096 | 0.70 | P2RX7 (0.31) | — | |
| SCHEMBL8534414 | 0.68 | — | — | |
| SCHEMBL8879528 | 0.66 | — | — | |
| SCHEMBL1139842 | 0.65 | FFAR3 (0.35) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2934118-B1 | PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2018-01-31 | — | — | EP | disclosed |
| US-9630910-B2 | Pesticidal compositions and processes related thereto | DOW AGROSCIENCES LLC (US) | 2017-04-25 | — | — | US | disclosed |
| US-20160037771-A1 | PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2016-02-11 | — | — | US | disclosed |