⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4823417 | 0.86 | MEN1 (0.39) | — | |
| SCHEMBL4820601 | 0.85 | OXTR (0.31) | — | |
| SCHEMBL4669442 | 0.85 | DGAT1 (0.32) | — | |
| SCHEMBL3145281 | 0.81 | — | — | |
| SCHEMBL4825426 | 0.80 | HTT (0.40) | — | |
| SCHEMBL4825674 | 0.76 | FPR2 (0.30) | — | |
| SCHEMBL4821917 | 0.72 | FDFT1 (0.36) | — | |
| SCHEMBL4823642 | 0.71 | IDO1 (0.34) | — | |
| SCHEMBL4670942 | 0.70 | MAPT (0.34) | — | |
| SCHEMBL4824088 | 0.70 | MEN1 (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-20080146621-A1 | Polysubstituted 1,1-pyridylaminocyclopropanamine compounds | LES LABORATORIES SERVIER (FR) | 2008-06-19 | — | — | US | disclosed |
| US-7388022-B2 | Polysubstituted 1,1-pyridylaminocyclopropanamine compounds | LES LABORATOIRES SERVIER (FR) | 2008-06-17 | — | — | US | disclosed |
| US-20070027192-A1 | Polysubstituted 1,1-pyridylamioncyclopropanamine compounds | LES LABORATOIRES SERVIER (FR) | 2007-02-01 | — | — | US | disclosed |