⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24189 | 0.64 | — | — | |
| SCHEMBL283784 | 0.61 | — | — | |
| SCHEMBL57647 | 0.61 | — | — | |
| SCHEMBL2913542 | 0.59 | — | — | |
| SCHEMBL1266806 | 0.57 | — | — | |
| SCHEMBL8331 | 0.56 | — | — | |
| SCHEMBL2901594 | 0.56 | — | — | |
| SCHEMBL11157846 | 0.56 | — | — | |
| SCHEMBL130030 | 0.56 | — | — | |
| SCHEMBL8769955 | 0.53 | — | — |
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-5416068-A | Alpha-phenylacrylic acid derivatives, their preparation and their use for controlling pests and harmful fungi | BASF AKTIENGESELLSCHAFT (DE) | 1995-05-16 | — | — | US | disclosed |
| US-5298527-A | Insecticides | BASF AKTIENGESELLSCHAFT (DE) | 1994-03-29 | — | — | US | disclosed |