⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2035507 | 0.80 | — | — | |
| SCHEMBL17234164 | 0.79 | — | — | |
| SCHEMBL7162421 | 0.79 | — | — | |
| SCHEMBL10556609 | 0.76 | TSHR (0.43) | — | |
| SCHEMBL27493632 | 0.76 | — | — | |
| SCHEMBL7715982 | 0.76 | TSHR (0.43) | — | |
| SCHEMBL12572409 | 0.76 | — | — | |
| SCHEMBL11272361 | 0.74 | — | — | |
| SCHEMBL3000944 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL29773797 | 0.72 | FFAR3 (0.41) | — |
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-20100189798-A1 | CONTROL OF ERWINIA AMYLOVORA WITH VINYLGLYCINES AND BACTERIA THAT PRODUCE VINYLGLYCINES | THE STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF | 2010-07-29 | — | — | US | disclosed |