⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2197391 | 0.81 | KMT2A (0.40) | — | |
| SCHEMBL6939540 | 0.74 | ELANE (0.34) | — | |
| SCHEMBL11239979 | 0.74 | — | — | |
| SCHEMBL2201861 | 0.69 | SMN1; SMN2 (0.54) | — | |
| SCHEMBL2202711 | 0.69 | CES2 (0.53) | — | |
| SCHEMBL12334993 | 0.69 | — | — | |
| SCHEMBL105221 | 0.68 | KMT2A (0.40) | — | |
| SCHEMBL2198986 | 0.67 | CES2 (0.58) | — | |
| SCHEMBL27755064 | 0.67 | LMNA (0.40) | — | |
| SCHEMBL27991990 | 0.65 | GABRA5 (0.48) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106164066-A | Cyclopropylamines as lsd1 inhibitors | 因赛特公司 | 2016-11-23 | — | — | CN | disclosed |