⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19899774 | 0.68 | — | — | |
| SCHEMBL2353670 | 0.67 | KEAP1 (0.38) | — | |
| SCHEMBL4804071 | 0.64 | EGLN2 (0.30) | — | |
| SCHEMBL236146 | 0.61 | MGLL (0.47) | — | |
| SCHEMBL3996432 | 0.60 | KDM4E (0.30) | — | |
| SCHEMBL8050140 | 0.60 | KDM4E (0.37) | — | |
| SCHEMBL4032174 | 0.60 | HTT (0.44) | — | |
| SCHEMBL19878897 | 0.59 | — | — | |
| Hydrochloric Acid SCHEMBL28019904 | 0.59 | MGLL (0.44) | — | |
| SCHEMBL170249 | 0.55 | TSHR (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010075356-A1 | NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-07-01 | — | — | WO | disclosed |
| US-20100160323-A1 | NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-06-24 | — | — | US | disclosed |