⚠ 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 | |
|---|---|---|---|---|
| 3-Pentanol SCHEMBL28115150 | 0.75 | — | — | |
| SCHEMBL4830451 | 0.73 | — | — | |
| SCHEMBL12341066 | 0.73 | — | — | |
| SCHEMBL27643 | 0.73 | — | — | |
| SCHEMBL15223405 | 0.73 | — | — | |
| SCHEMBL7708608 | 0.73 | — | — | |
| SCHEMBL55046 | 0.73 | — | — | |
| SCHEMBL265475 | 0.73 | — | — | |
| SCHEMBL638400 | 0.73 | — | — | |
| SCHEMBL7711730 | 0.73 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0582789-B1 | Novel 7-(substituted)-8-(substituted)-9-(substituted glycyl)amido-6-demethyl-6-deoxytetracyclines | AMERICAN CYANAMID CO (US) | 2001-10-04 | — | — | EP | disclosed |