⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1958323 | 0.75 | — | — | |
| SCHEMBL8530818 | 0.75 | — | — | |
| SCHEMBL14309283 | 0.70 | — | — | |
| SCHEMBL6865344 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL6865342 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL28127341 | 0.70 | — | — | |
| SCHEMBL11350586 | 0.70 | — | — | |
| SCHEMBL11350589 | 0.70 | — | — | |
| SCHEMBL14212902 | 0.70 | — | — | |
| SCHEMBL24728059 | 0.69 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8329988-B2 | Method for increasing pathogen resistance in transgenic plants | BASF PLANT SCIENCE GMBH (DE) | 2012-12-11 | — | — | US | disclosed |