⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3131021 | 0.82 | — | — | |
| SCHEMBL27681828 | 0.82 | — | — | |
| SCHEMBL27824735 | 0.82 | — | — | |
| SCHEMBL7734304 | 0.67 | — | — | |
| SCHEMBL7518798 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7984861 | 0.67 | — | — | |
| Water SCHEMBL14563517 | 0.67 | — | — | |
| SCHEMBL21751274 | 0.67 | — | — | |
| SCHEMBL7881942 | 0.67 | — | — | |
| SCHEMBL9616794 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4002697-A | — | — | None | — | — | JP | disclosed |
| JP-H042697-A | OXIDE SINGLE CRYSTAL BASE, SUPERCONDUCTOR DEVICE USING THEREOF AND PRODUCTION OF SAME DEVICE | KOMATSU LTD | 1992-01-07 | — | — | JP | disclosed |