⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4556157 | 0.97 | — | — | |
| SCHEMBL27868483 | 0.94 | THRB (0.50) | — | |
| SCHEMBL13551004 | 0.94 | THRB (0.50) | — | |
| SCHEMBL10940757 | 0.94 | — | — | |
| SCHEMBL12760684 | 0.94 | THRB (0.50) | — | |
| SCHEMBL17009071 | 0.94 | THRB (0.50) | — | |
| SCHEMBL28160682 | 0.94 | — | — | |
| Tetramethylammonium Ion SCHEMBL17865408 | 0.88 | DNM1 (0.38) | — | |
| SCHEMBL488039 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL27479641 | 0.84 | — | — |
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-6562953-B2 | Process which is useful for converting the carbonyl function in position 4″ of the cladinose unit of an aza-macrolide into an amine derivative | MERIAL (FR) | 2003-05-13 | — | — | US | disclosed |
| US-20020013454-A1 | Process which is useful for converting the carbonyl function in position 4\" of the cladinose unit of an aza-macrolide into an amine derivative | MERIAL (FR) | 2002-01-31 | — | — | US | disclosed |