⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7467336 | 0.73 | — | — | |
| SCHEMBL25585269 | 0.70 | — | — | |
| SCHEMBL18602707 | 0.67 | — | — | |
| SCHEMBL48575 | 0.65 | — | — | |
| SCHEMBL28081962 | 0.65 | — | — | |
| SCHEMBL10054281 | 0.65 | — | — | |
| SCHEMBL1682929 | 0.65 | — | — | |
| SCHEMBL21555480 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL1913494 | 0.60 | — | — | |
| SCHEMBL9505962 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020250223-A1 | NOVEL NON-CODING HETEROCYCLIC AMINO ACIDS (NCHAA) AND THEIR USE AS HERBICIDES | FORTEPHEST LTD. (IL) | 2020-12-17 | — | — | WO | disclosed |