⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28265257 | 0.71 | — | — | |
| SCHEMBL8545100 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL16225252 | 0.67 | — | — | |
| SCHEMBL689708 | 0.65 | — | — | |
| SCHEMBL10344956 | 0.65 | — | — | |
| SCHEMBL4941657 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL10723962 | 0.63 | TSHR (0.41) | — | |
| SCHEMBL763416 | 0.60 | — | — | |
| SCHEMBL24872770 | 0.59 | — | — | |
| SCHEMBL29306705 | 0.59 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102574801-B | Substituted aminopropionic acid derivatives as enkephalinase inhibitors | NOVARTIS AG (CH) | 2016-04-27 | — | — | CN | disclosed |
| CN-103896796-B | As the alanine derivatives of the replacement of enkephalinase inhibitor | NOVARTIS AG (CH) | 2016-04-27 | — | — | CN | disclosed |