⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL190371 | 0.83 | — | — | |
| SCHEMBL10568027 | 0.80 | — | — | |
| SCHEMBL487651 | 0.80 | — | — | |
| SCHEMBL28237965 | 0.80 | — | — | |
| SCHEMBL7622015 | 0.80 | — | — | |
| SCHEMBL14437805 | 0.77 | — | — | |
| SCHEMBL2499431 | 0.77 | — | — | |
| SCHEMBL27830156 | 0.77 | — | — | |
| SCHEMBL39837 | 0.76 | — | — | |
| SCHEMBL13986583 | 0.76 | ALDH1A1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101641767-B | Silicon dielectric treating agent for use after etching, process for producing semiconductor device, and semiconductor device | FUJITSU LTD | 2013-10-30 | — | — | CN | disclosed |