⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25007406 | 0.80 | CA12 (0.34) | — | |
| SCHEMBL1535835 | 0.80 | — | — | |
| SCHEMBL8659556 | 0.77 | MME (0.32) | — | |
| SCHEMBL967670 | 0.76 | — | — | |
| SCHEMBL967673 | 0.76 | — | — | |
| SCHEMBL497965 | 0.76 | — | — | |
| SCHEMBL497964 | 0.74 | — | — | |
| SCHEMBL19722741 | 0.74 | — | — | |
| SCHEMBL966578 | 0.74 | — | — | |
| SCHEMBL12674137 | 0.74 | MLYCD (0.36) | — |
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-4124591-A | HERBICIDES, PLANT GROWTH REGULATORS | BASF AKTIENGESELLSCHAFT (DE) | 1978-11-07 | — | — | US | disclosed |