⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5494536 | 0.78 | ACHE (0.44) | — | |
| SCHEMBL5488498 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL8730421 | 0.72 | ALDH1A1 (0.41) | — | |
| SCHEMBL5490217 | 0.71 | IDO1 (0.38) | — | |
| SCHEMBL5413664 | 0.71 | TAAR1 (0.52) | — | |
| SCHEMBL5484319 | 0.70 | ADRB2 (0.46) | — | |
| SCHEMBL5485069 | 0.69 | HDAC4 (0.39) | — | |
| SCHEMBL5492047 | 0.68 | KMT2A (0.34) | — | |
| SCHEMBL5483548 | 0.68 | CASR (0.38) | — | |
| SCHEMBL5487989 | 0.68 | PYCR1 (0.37) | — |
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-7291747-B2 | Silicon compounds and process for preparation thereof | CHISSO CORPORATION (JP) | 2007-11-06 | — | — | US | disclosed |
| US-20040143081-A1 | Novel silicon compounds and process for preparation thereof | JNC CORPORATION (JP) | 2004-07-22 | — | — | US | disclosed |