⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15900171 | 0.82 | — | — | |
| SCHEMBL16823316 | 0.78 | — | — | |
| SCHEMBL17074177 | 0.77 | — | — | |
| SCHEMBL17542612 | 0.77 | — | — | |
| SCHEMBL17363051 | 0.74 | LMNA (0.30) | — | |
| SCHEMBL15910747 | 0.74 | — | — | |
| SCHEMBL343056 | 0.73 | LMNA (0.33) | — | |
| SCHEMBL2873479 | 0.73 | LMNA (0.33) | — | |
| SCHEMBL15910863 | 0.73 | USP2 (0.32) | — | |
| SCHEMBL1062985 | 0.72 | LMNA (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140212381-A1 | MACROCYCLES | SCYNEXIS, INC. (US) | 2014-07-31 | — | — | US | disclosed |
| US-20140213508-A1 | ANTIVIRAL MACROCYCLES | SCYNEXIS, INC. (US) | 2014-07-31 | — | — | US | disclosed |
| US-20100317698-A1 | Polysubstituted Pyridinylaminoalkylene- and Pyridinyloxyalkylene-Cyclopropanamine Compounds, a Process for Their Preparation and Pharmaceutical Compositions Containing Them | LES LABORATOIRES SERVIER (FR) | 2010-12-16 | — | — | US | disclosed |