⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9314648 | 0.88 | — | — | |
| SCHEMBL9313418 | 0.77 | TDP1 (0.32) | — | |
| SCHEMBL9313407 | 0.72 | — | — | |
| SCHEMBL9314607 | 0.72 | CASP1 (0.30) | — | |
| SCHEMBL9669542 | 0.71 | — | — | |
| SCHEMBL9314518 | 0.70 | TDP1 (0.33) | — | |
| SCHEMBL9313404 | 0.67 | TDP1 (0.32) | — | |
| SCHEMBL4970697 | 0.67 | — | — | |
| SCHEMBL9313391 | 0.66 | — | — | |
| SCHEMBL9696715 | 0.66 | TDP1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5286721-A | Antimicrobial agents | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-02-15 | — | — | US | disclosed |
| WO-1992006978-A1 | 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-04-30 | — | — | WO | disclosed |