⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4416900 | 0.92 | — | — | |
| SCHEMBL4423884 | 0.82 | GABRR1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL4412458 | 0.81 | GABRR1 (0.31) | — | |
| SCHEMBL4418062 | 0.80 | KDM1A (0.30) | — | |
| SCHEMBL4411243 | 0.75 | — | — | |
| SCHEMBL7232199 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7233626 | 0.70 | SLC6A12 (0.30) | — | |
| SCHEMBL4422850 | 0.67 | — | — | |
| SCHEMBL4413595 | 0.67 | — | — | |
| SCHEMBL28672657 | 0.67 | KDM4E (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1040094-B9 | SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS | BIOCRYST PHARM INC (US) | 2015-09-09 | — | — | EP | claimed |
| EP-1040094-B1 | SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS | BIOCRYST PHARM INC (US) | 2009-03-18 | — | — | EP | claimed |