⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27464039 | 0.74 | — | — | |
| SCHEMBL3949737 | 0.69 | — | — | |
| SCHEMBL5706671 | 0.69 | — | — | |
| SCHEMBL7132326 | 0.67 | — | — | |
| SCHEMBL17218132 | 0.67 | CA2 (0.31) | — | |
| SCHEMBL17216805 | 0.67 | — | — | |
| SCHEMBL17216121 | 0.66 | CA2 (0.30) | — | |
| SCHEMBL17218445 | 0.66 | CHRM2 (0.33) | — | |
| SCHEMBL17404787 | 0.65 | CA2 (0.42) | — | |
| SCHEMBL18537903 | 0.65 | CA2 (0.42) | — |
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-5866594-A | Indole-2-carboxylate derivatives and fungicidal compositions for agricultural or horticultural use containing the derivatives as active component | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1999-02-02 | — | — | US | disclosed |
| EP-0791582-A1 | INDOLE-2-CARBOXYLIC ESTER DERIVATIVES AND AGRICULTURAL AND HORTICULTURAL BACTERIOCIDES CONTAINING THE SAME AS THE ACTIVE INGREDIENT | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1997-08-27 | — | — | EP | disclosed |