⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7992329 | 0.93 | HDAC4 (0.44) | — | |
| SCHEMBL7994423 | 0.91 | HDAC4 (0.42) | — | |
| SCHEMBL9069679 | 0.76 | — | — | |
| SCHEMBL20850021 | 0.76 | — | — | |
| SCHEMBL3133890 | 0.75 | — | — | |
| SCHEMBL4449518 | 0.75 | HDAC4 (0.48) | — | |
| Alcohol SCHEMBL28289077 | 0.74 | HDAC2 (0.48) | — | |
| SCHEMBL720598 | 0.71 | — | — | |
| SCHEMBL9363245 | 0.71 | HDAC4 (0.45) | — | |
| SCHEMBL8894092 | 0.71 | HDAC2 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6277790-B1 | APPLYING PLANTS, SEEDS, SOILS OR ENVIRONMENT | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-21 | — | — | US | disclosed |