⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14795253 | 0.75 | — | — | |
| SCHEMBL20783127 | 0.75 | LMNA (0.35) | — | |
| SCHEMBL25960852 | 0.73 | — | — | |
| SCHEMBL16837161 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL16776689 | 0.71 | NOS2 (0.37) | — | |
| SCHEMBL11036537 | 0.70 | LMNA (0.32) | — | |
| SCHEMBL15671631 | 0.68 | LMNA (0.31) | — | |
| SCHEMBL12951345 | 0.68 | LMNA (0.31) | — | |
| SCHEMBL21624579 | 0.67 | ALOX15 (0.33) | — | |
| SCHEMBL28280664 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7569690-B2 | Process for producing oxycarbonyl-substituted piperazine derivative | TORAY FINE CHEMICALS CO., LTD. (JP) | 2009-08-04 | — | — | US | disclosed |
| US-20060161003-A1 | Process for producing oxycarbonyl-substituted piperazine derivative | TORAY FINE CHEMICALS CO., LTD. (JP) | 2006-07-20 | — | — | US | disclosed |
| EP-1548010-A1 | PROCESS FOR PRODUCING OXYCARBONYL-SUBSTITUTED PIPERAZINE DERIVATIVE | Toray Fine Chemicals Co., Ltd. (JP) | 2005-06-29 | — | — | EP | disclosed |