⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL425466 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL29494595 | 0.74 | — | — | |
| SCHEMBL18056791 | 0.74 | — | — | |
| SCHEMBL1704447 | 0.74 | — | — | |
| SCHEMBL27857729 | 0.74 | — | — | |
| SCHEMBL154159 | 0.74 | — | — | |
| SCHEMBL12869941 | 0.72 | MAOA (0.33) | — | |
| SCHEMBL8080053 | 0.72 | HDAC8 (0.46) | — | |
| SCHEMBL2733235 | 0.72 | POLB (0.42) | — | |
| Hydrochloric Acid SCHEMBL9200108 | 0.72 | CTSD (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000136177-A | PRODUCTION OF N-ALKYL-ALPHA-DIALKYLAMINOACETO- HYDROXAMIC ACID COMPOUND | FUJI PHOTO FILM CO LTD | 2000-05-16 | — | — | JP | disclosed |