⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9712786 | 1.00 | — | — | |
| SCHEMBL21457930 | 0.82 | — | — | |
| SCHEMBL9712721 | 0.78 | — | — | |
| SCHEMBL9712567 | 0.78 | FAAH (0.32) | — | |
| SCHEMBL9712718 | 0.78 | — | — | |
| SCHEMBL9712562 | 0.78 | FAAH (0.32) | — | |
| SCHEMBL9712592 | 0.74 | LPAR2 (0.33) | — | |
| SCHEMBL31029282 | 0.72 | FAAH (0.38) | — | |
| SCHEMBL31108849 | 0.72 | FAAH (0.38) | — | |
| SCHEMBL31108859 | 0.72 | FAAH (0.38) | — |
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-5081287-A | Pesticidal polyhalo alkenoic acid esters | FMC CORPORATION (US) | 1992-01-14 | — | — | US | disclosed |