⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL932978 | 0.71 | — | — | |
| SCHEMBL16114009 | 0.71 | — | — | |
| SCHEMBL2901458 | 0.71 | — | — | |
| SCHEMBL28186098 | 0.71 | — | — | |
| SCHEMBL1250399 | 0.71 | — | — | |
| SCHEMBL25165563 | 0.67 | — | — | |
| SCHEMBL23699960 | 0.67 | — | — | |
| SCHEMBL18667339 | 0.67 | — | — | |
| SCHEMBL24166406 | 0.67 | CCNE1 (0.36) | — | |
| SCHEMBL18215491 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012013728-A1 | ARYLCYCLOPROPYLAMINE BASED DEMETHYLASE INHIBITORS OF LSD1 AND THEIR MEDICAL USE | ORYZON GENOMICS S.A. (ES) | 2012-02-02 | — | — | WO | disclosed |