⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL177640 | 0.73 | — | — | |
| SCHEMBL4851225 | 0.73 | CRBN (0.47) | — | |
| Diacetamide SCHEMBL28998044 | 0.72 | — | — | |
| Diacetamide SCHEMBL97089 | 0.71 | — | — | |
| SCHEMBL8935555 | 0.71 | — | — | |
| SCHEMBL12562103 | 0.69 | — | — | |
| SCHEMBL13788471 | 0.69 | — | — | |
| SCHEMBL11052974 | 0.69 | — | — | |
| SCHEMBL12967920 | 0.69 | — | — | |
| SCHEMBL11038761 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2018081367-A1 | CYCLIC PEPTIDE TYROSINE TYROSINE COMPOUNDS AS MODULATORS OF NEUROPEPTIDE Y RECEPTORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-05-03 | — | — | WO | disclosed |