⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8644356 | 0.81 | — | — | |
| SCHEMBL8644358 | 0.81 | — | — | |
| SCHEMBL9811361 | 0.81 | — | — | |
| SCHEMBL8700200 | 0.80 | — | — | |
| SCHEMBL9811315 | 0.78 | BRD4 (0.32) | — | |
| SCHEMBL8784545 | 0.76 | MAPT (0.31) | — | |
| SCHEMBL8697639 | 0.76 | MAPT (0.31) | — | |
| SCHEMBL8694211 | 0.76 | MAPT (0.31) | — | |
| SCHEMBL10415296 | 0.75 | ITGB1 (0.34) | — | |
| SCHEMBL9811345 | 0.75 | ITGB1 (0.34) | — |
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-0223588-B1 | PROCESS FOR THE PREPARATION OF BETA-LACTAM COMPOUNDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-06-12 | — | — | EP | disclosed |