⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15351948 | 0.74 | — | — | |
| SCHEMBL1766309 | 0.69 | — | — | |
| SCHEMBL11798715 | 0.67 | — | — | |
| SCHEMBL11800141 | 0.67 | — | — | |
| SCHEMBL744461 | 0.66 | — | — | |
| SCHEMBL1531221 | 0.66 | — | — | |
| SCHEMBL9319070 | 0.65 | — | — | |
| SCHEMBL762218 | 0.65 | — | — | |
| SCHEMBL9510516 | 0.65 | — | — | |
| SCHEMBL11782371 | 0.64 | CHRNB2 (0.31) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995000499-A1 | HERBICIDAL SUBSTITUTED 1,5-DIARYL-1H-1,2,4-TRIAZOL-3-CARBOXAMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1995-01-05 | — | — | WO | disclosed |
| EP-0345597-B1 | O-halo-cyclobutyl-S-alkyl-(di)thiophosphonic(phosphoric) acid esters, process for their preparation and their use as pesticides | BAYER AG (DE) | 1993-10-27 | — | — | EP | disclosed |
| US-5166144-A | Insecticides, miticides, nematocides | BAYER AKTIENGESELLSCHAFT (DE) | 1992-11-24 | — | — | US | disclosed |
| EP-0507142-A2 | O-halocyclobutyl-S-alkyl-(di) thiophosphoric acid ester amides, process for their preparation and their use as pesticides | BAYER AG (DE) | 1992-10-07 | — | — | EP | disclosed |
| US-4973583-A | Pesticidal O-halogenocyclobutyl S-alkyl (di)thiphosph)(on)ates | BAYER AKTIENGESELLSCHAFT (DE) | 1990-11-27 | — | — | US | disclosed |
| EP-0345597-A2 | O-halo-cyclobutyl-S-alkyl-(di)thiophosphonic(phosphoric) acid esters, process for their preparation and their use as pesticides | BAYER AG (DE) | 1989-12-13 | — | — | EP | disclosed |