⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5802971 | 0.71 | HCAR2 (0.31) | — | |
| SCHEMBL15415821 | 0.71 | — | — | |
| SCHEMBL2648320 | 0.70 | SLC6A2 (0.36) | — | |
| SCHEMBL1906092 | 0.68 | SLC6A2 (0.32) | — | |
| SCHEMBL28873476 | 0.66 | MEN1 (0.33) | — | |
| SCHEMBL1386444 | 0.63 | MEN1 (0.33) | — | |
| SCHEMBL28193456 | 0.63 | SLC6A2 (0.35) | — | |
| SCHEMBL6897214 | 0.61 | — | — | |
| SCHEMBL9557656 | 0.61 | HTR6 (0.36) | — | |
| SCHEMBL1966529 | 0.61 | HTR6 (0.41) | — |
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 |