⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8407544 | 0.67 | — | — | |
| SCHEMBL10703221 | 0.67 | — | — | |
| SCHEMBL27530337 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL9197819 | 0.59 | — | — | |
| SCHEMBL4367674 | 0.56 | — | — | |
| Water SCHEMBL28847822 | 0.56 | — | — | |
| Water SCHEMBL27949665 | 0.56 | — | — | |
| Water SCHEMBL526949 | 0.50 | — | — | |
| SCHEMBL20472008 | 0.50 | — | — | |
| Water SCHEMBL7466737 | 0.50 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160137603-A1 | PROCESS FOR THE PREPARATION OF CERTAIN SUBSTITUTED SULFILIMINES | DOW AGROSCIENCES LLC (US) | 2016-05-19 | — | — | US | disclosed |
| CN-105324365-A | Improved process for the preparation of n-cyano-s-[1 -(pyridin-3-yl)ethyl]-s-methylsulfilimines | DOW AGROSCIENCES LLC | 2016-02-10 | — | — | CN | disclosed |
| EP-2931706-A1 | IMPROVED PROCESS FOR THE PREPARATION OF!N-CYANO-S-[1 -(PYRIDIN-3-YL)ETHYL]-S-METHYLSULFILIMINES | Dow AgroSciences LLC (US) | 2015-10-21 | — | — | EP | disclosed |
| WO-2014093276-A1 | IMPROVED PROCESS FOR THE PREPARATION OF|N-CYANO-S-[1 -(PYRIDIN-3-YL)ETHYL]-S-METHYLSULFILIMINES | DOW AGROSCIENCES LLC (US) | 2014-06-19 | — | — | WO | disclosed |
| US-20140163236-A1 | PROCESS FOR THE PREPARATION OF CERTAIN SUBSTITUTED SULFILIMINES | DOW AGROSCIENCES LLC (US) | 2014-06-12 | — | — | US | disclosed |