⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12818334 | 0.70 | — | — | |
| SCHEMBL9851237 | 0.67 | — | — | |
| SCHEMBL1266161 | 0.67 | — | — | |
| SCHEMBL3044693 | 0.67 | — | — | |
| SCHEMBL3075677 | 0.66 | — | — | |
| SCHEMBL4742600 | 0.64 | — | — | |
| SCHEMBL13757698 | 0.64 | — | — | |
| SCHEMBL24061655 | 0.62 | — | — | |
| SCHEMBL14076040 | 0.62 | — | — | |
| SCHEMBL28126461 | 0.58 | — | — |
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-63150286-A | — | — | None | — | — | JP | disclosed |
| EP-0429372-A1 | 2-Azolyl nicotinate derivatives as herbicides | RHONE-POULENC AGROCHIMIE (FR) | 1991-05-29 | — | — | EP | disclosed |
| JP-S63150286-A | DIHYDROPYRANO(3,3-B)PYRIDINE DERIVATIVE, PRODUCTION THEREOF AND ANTIULCER AGENT CONTAINING SAID DERIVATIVE | ZERIA SHINYAKU KOGYO KK | 1988-06-22 | — | — | JP | disclosed |