⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6365551 | 0.79 | — | — | |
| SCHEMBL18686730 | 0.77 | L3MBTL1 (0.38) | — | |
| SCHEMBL4360274 | 0.76 | L3MBTL1 (0.32) | — | |
| SCHEMBL8618624 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL18686732 | 0.74 | MEN1 (0.36) | — | |
| Alcohol SCHEMBL10920689 | 0.73 | BRD4 (0.36) | — | |
| SCHEMBL7804731 | 0.72 | — | — | |
| SCHEMBL9957501 | 0.71 | CA12 (0.32) | — | |
| SCHEMBL14357416 | 0.70 | GAA (0.39) | — | |
| SCHEMBL317354 | 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 |
|---|---|---|---|---|---|---|---|
| US-7183301-B2 | Heterocyclic compounds having antibacterial activity: process for their preparation and pharmaceutical compositions containing them | DR. REDDY'S RESEARCH FOUNDATION (IN) | 2007-02-27 | — | — | US | disclosed |
| US-20070004712-A1 | Salts of novel heterocyclic compounds having antibacterial activity | DR. REDDY'S LABORATORIES LTD. (IN) | 2007-01-04 | — | — | US | disclosed |