⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19399273 | 0.79 | — | — | |
| SCHEMBL27389127 | 0.78 | — | — | |
| SCHEMBL27388114 | 0.78 | — | — | |
| SCHEMBL21214452 | 0.78 | — | — | |
| SCHEMBL21161382 | 0.77 | — | — | |
| SCHEMBL25101435 | 0.73 | — | — | |
| SCHEMBL12919814 | 0.73 | — | — | |
| SCHEMBL791153 | 0.73 | — | — | |
| SCHEMBL17424317 | 0.73 | — | — | |
| SCHEMBL19733988 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230028700-A1 | CHIRAL GUANIDINES, SALTS THEREOF, METHODS OF MAKING CHIRAL GUANIDINES AND SALTS THEREOF, AND USES OF CHIRAL GUANIDINES AND SALTS THEREOF IN THE PREPARATION OF ENANTIOMERICALLY PURE AMINO ACIDS | FU RUI (CA) | 2023-01-26 | — | — | US | disclosed |
| US-20180015186-A1 | Compositions And Methods For In Vivo Imaging | THE GENERAL HOSPITAL CORPORATION | 2018-01-18 | — | — | US | disclosed |