⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10724422 | 0.78 | — | — | |
| SCHEMBL2077030 | 0.72 | — | — | |
| SCHEMBL9643382 | 0.64 | — | — | |
| SCHEMBL1065534 | 0.63 | — | — | |
| SCHEMBL3573061 | 0.61 | — | — | |
| SCHEMBL10728844 | 0.59 | — | — | |
| SCHEMBL4446778 | 0.57 | — | — | |
| SCHEMBL988025 | 0.55 | — | — | |
| SCHEMBL1140316 | 0.55 | — | — | |
| SCHEMBL3996719 | 0.55 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0245066-A2 | Method for plant growth regulation | ELI LILLY AND COMPANY (US) | 1987-11-11 | — | — | EP | disclosed |
| US-4704156-A | TRIHALOCYCLOPROPANECARBOXYLIC ACID DERIVATIVES | ELI LILLY AND COMPANY (US) | 1987-11-03 | — | — | US | disclosed |