⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11428433 | 0.88 | — | — | |
| SCHEMBL26527477 | 0.72 | — | — | |
| SCHEMBL31646280 | 0.69 | — | — | |
| SCHEMBL11425194 | 0.67 | — | — | |
| SCHEMBL5970385 | 0.65 | — | — | |
| SCHEMBL641324 | 0.61 | — | — | |
| SCHEMBL1194886 | 0.61 | — | — | |
| SCHEMBL11321934 | 0.61 | — | — | |
| SCHEMBL7573395 | 0.59 | FFAR3 (0.38) | — | |
| SCHEMBL17164425 | 0.59 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4208409-A | N-[(phosphinyl or phosphinothioyl)amino]thio-methylcarbamates and pesticidal methods | THE UPJOHN COMPANY (US) | 1980-06-17 | — | — | US | disclosed |
| US-4201733-A | PESTICIDES | THE UPJOHN COMPANY (US) | 1980-05-06 | — | — | US | disclosed |
| US-4081536-A | N-[(phosphinyl) amino]thio- and N-[(phosphinothioyl)amino]-thio-methylcarbamates and methods for controlling insects | THE UPJOHN COMPANY (US) | 1978-03-28 | — | — | US | disclosed |