⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8214785 | 0.83 | GAA (0.30) | — | |
| SCHEMBL8216406 | 0.77 | — | — | |
| SCHEMBL8219304 | 0.76 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL8215727 | 0.71 | — | — | |
| SCHEMBL7896320 | 0.70 | ESR1 (0.39) | — | |
| SCHEMBL8207319 | 0.67 | — | — | |
| SCHEMBL8215441 | 0.66 | — | — | |
| SCHEMBL8216464 | 0.65 | — | — | |
| SCHEMBL8208259 | 0.65 | — | — | |
| SCHEMBL8208010 | 0.63 | — | — |
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-6136995-A | Process for producing aminosilane compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-10-24 | — | — | US | disclosed |