⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11243530 | 1.00 | — | — | |
| SCHEMBL8427631 | 0.80 | — | — | |
| SCHEMBL3506516 | 0.75 | — | — | |
| SCHEMBL607368 | 0.73 | — | — | |
| SCHEMBL5391387 | 0.73 | — | — | |
| SCHEMBL11224887 | 0.72 | NOS1 (0.50) | — | |
| SCHEMBL11234179 | 0.72 | NOS1 (0.41) | — | |
| SCHEMBL11234194 | 0.72 | NOS1 (0.41) | — | |
| SCHEMBL11224917 | 0.72 | NOS1 (0.50) | — | |
| SCHEMBL1680220 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4359469-A | Combating pests with N-sulphenylated oxime-carbamates | BAYER AKTIENGESELLSCHAFT (DE) | 1982-11-16 | — | — | US | disclosed |
| EP-0005780-A1 | N,N'-asymmetrically substituted thio-bis-amines, process for their preparation and their use as insecticides, acaricides and nematocides | BAYER AG (DE) | 1979-12-12 | — | — | EP | disclosed |