⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2815641 | 0.80 | — | — | |
| SCHEMBL996730 | 0.80 | — | — | |
| SCHEMBL136291 | 0.74 | — | — | |
| SCHEMBL231107 | 0.72 | — | — | |
| SCHEMBL21520 | 0.72 | — | — | |
| SCHEMBL30548743 | 0.72 | — | — | |
| SCHEMBL1005748 | 0.70 | — | — | |
| SCHEMBL9309084 | 0.70 | TRPA1 (0.46) | — | |
| Water SCHEMBL28356442 | 0.70 | TRPA1 (0.46) | — | |
| SCHEMBL1952040 | 0.70 | TRPA1 (0.46) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1104410-C | Phenyl acetic acid derivatives, process and intermediate products for their production and agents containing them | BASF AG (DE) | 2003-04-02 | — | — | CN | disclosed |
| CN-1075807-C | Iminooxymethyleneanilides, their preparation and intermediates therefor and pesticides containing them | BASF AG (DE) | 2001-12-05 | — | — | CN | disclosed |
| CN-1046706-C | Phenylacetic acid derivatives, their preparation and related intermediates, and compositions containing them | BASF AG (DE) | 1999-11-24 | — | — | CN | disclosed |
| CN-1201449-A | Phenylacetic acid derivatives, preparation process and their use as fungicides and pesticides | BASF AG (DE) | 1998-12-09 | — | — | CN | disclosed |
| CN-1199393-A | Oxyamino oxime ethers, methods and intermediate products for their production, and composition contg. them and used for controlling harmful fungi and pests | BASF AG (DE) | 1998-11-18 | — | — | CN | disclosed |
| CN-1143359-A | Phenyl acetic acid derivatives, process and intermediate products for their production and agents containing them | BASF AG (DE) | 1997-02-19 | — | — | CN | disclosed |