⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20126152 | 0.99 | NPSR1 (0.31) | — | |
| SCHEMBL20126196 | 0.89 | — | — | |
| SCHEMBL20126127 | 0.82 | — | — | |
| SCHEMBL20126189 | 0.71 | — | — | |
| SCHEMBL20126318 | 0.71 | — | — | |
| SCHEMBL20126295 | 0.71 | NR3C2 (0.32) | — | |
| SCHEMBL20126195 | 0.69 | KDM1A (0.33) | — | |
| SCHEMBL18540271 | 0.69 | TAAR1 (0.36) | — | |
| SCHEMBL20126123 | 0.67 | FFAR1 (0.35) | — | |
| SCHEMBL18540205 | 0.67 | RARB (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180127654-A1 | PIPERIDINE DERIVATIVE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2018-05-10 | — | — | US | disclosed |
| US-20180127654-A1 | PIPERIDINE DERIVATIVE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2018-05-10 | — | — | US | disclosed |