⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9705600 | 0.72 | — | — | |
| SCHEMBL6046989 | 0.71 | — | — | |
| SCHEMBL31722685 | 0.71 | — | — | |
| SCHEMBL610247 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL9157805 | 0.71 | — | — | |
| SCHEMBL11059864 | 0.69 | — | — | |
| SCHEMBL9704811 | 0.69 | HRH4 (0.32) | — | |
| SCHEMBL19712133 | 0.67 | — | — | |
| SCHEMBL19786265 | 0.67 | — | — | |
| SCHEMBL2274344 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-4193886-A | — | — | None | — | — | JP | disclosed |
| JP-H04193886-A | N,N-DIALKYLAMINOALKYL-N',N'-DIALKYLAMINODIMETHYLSILANE | SHIN ETSU CHEM CO LTD | 1992-07-13 | — | — | JP | disclosed |
| EP-0488681-A1 | N, N-dialkylaminoalkyl-N', N'-dialkylaminodimethylsilane | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1992-06-03 | — | — | EP | disclosed |