⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1008473 | 0.86 | — | — | |
| SCHEMBL9325480 | 0.83 | — | — | |
| SCHEMBL6593656 | 0.82 | — | — | |
| SCHEMBL1006368 | 0.82 | — | — | |
| SCHEMBL80520 | 0.81 | KIF11 (0.31) | — | |
| SCHEMBL1006370 | 0.81 | — | — | |
| SCHEMBL1008558 | 0.79 | — | — | |
| SCHEMBL1006675 | 0.79 | — | — | |
| SCHEMBL1007315 | 0.79 | — | — | |
| SCHEMBL9528791 | 0.78 | — | — |
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-4975451-A | Insecticidal cyclopropyl di(aryl) 2-butenes | FMC CORPORATION (US) | 1990-12-04 | — | — | US | disclosed |