⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21248100 | 0.83 | TP53 (0.42) | — | |
| SCHEMBL15505265 | 0.81 | ALDH1A1 (0.41) | — | |
| SCHEMBL6906357 | 0.73 | — | — | |
| SCHEMBL13027307 | 0.72 | HPGD (0.34) | — | |
| SCHEMBL31494230 | 0.71 | ALDH1A1 (0.34) | — | |
| SCHEMBL31494220 | 0.71 | ALDH1A1 (0.34) | — | |
| SCHEMBL13027300 | 0.71 | — | — | |
| SCHEMBL15737219 | 0.71 | IDO1 (0.39) | — | |
| SCHEMBL16062870 | 0.71 | ESR1 (0.36) | — | |
| SCHEMBL21247626 | 0.70 | TP53 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6709715-B1 | DEPOSITING DIELECTRIC LAYER; USING SUCH AS TETRAVINYL-TETRAMETHYLCYCLOTETRASILOXANE, TETRAALLYLOXYSILANE OR TRIVINYLMETHYLSILANE | APPLIED MATERIALS INC. | 2004-03-23 | — | — | US | disclosed |