⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL341228 | 0.84 | CA1 (0.35) | — | |
| SCHEMBL19972017 | 0.83 | P2RX3 (0.30) | — | |
| SCHEMBL19971996 | 0.83 | — | — | |
| SCHEMBL19972003 | 0.76 | CA1 (0.30) | — | |
| SCHEMBL19197818 | 0.75 | CA1 (0.32) | — | |
| SCHEMBL3691524 | 0.73 | GAA (0.38) | — | |
| SCHEMBL10469286 | 0.72 | CA1 (0.33) | — | |
| SCHEMBL118738 | 0.71 | ALDH1A1 (0.39) | — | |
| SCHEMBL31261129 | 0.71 | ALDH1A1 (0.39) | — | |
| SCHEMBL19972014 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012074122-A1 | NEGATIVE PATTERN FORMING METHOD AND RESIST PATTERN | FUJIFILM CORPORATION (JP) | 2012-06-07 | — | — | WO | disclosed |