⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2746921 | 0.78 | — | — | |
| SCHEMBL5790804 | 0.69 | — | — | |
| SCHEMBL11546158 | 0.69 | — | — | |
| SCHEMBL13703431 | 0.69 | — | — | |
| SCHEMBL2771873 | 0.69 | — | — | |
| SCHEMBL951560 | 0.69 | — | — | |
| Perfluorotoluene SCHEMBL308464 | 0.67 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL7783594 | 0.67 | — | — | |
| SCHEMBL312356 | 0.67 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL22763299 | 0.65 | — | — |
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-RE38257-E1 | Piperdine derivatives and hypotensives containing the same | AJINOMOTO CO., INC. (JP) | 2003-09-23 | — | — | US | disclosed |
| US-6618186-B2 | Micro-electromechanical system | TEXAS INSTRUMENTS INCORPORATED | 2003-09-09 | — | — | US | disclosed |
| US-20020109903-A1 | Micro-electromechanical system | TEXAS INSTRUMENTS INCORPORATED | 2002-08-15 | — | — | US | disclosed |