⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16386437 | 0.81 | — | — | |
| SCHEMBL2894565 | 0.78 | — | — | |
| SCHEMBL21900600 | 0.78 | SLC6A3 (0.61) | — | |
| SCHEMBL3082071 | 0.77 | — | — | |
| SCHEMBL15581356 | 0.77 | — | — | |
| SCHEMBL10031019 | 0.77 | PKM (0.51) | — | |
| SCHEMBL91500 | 0.75 | — | — | |
| SCHEMBL17726977 | 0.74 | GAA (0.49) | — | |
| SCHEMBL16998591 | 0.74 | ALDH1A1 (0.71) | — | |
| SCHEMBL7250089 | 0.73 | — | — |
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-9206125-B2 | Use of compound binding to mSin3B that specifically binds to neuron restrictive silencer factor (NRSF) | PUBLIC UNIVERSITY CORPORATION YOKOHAMA CITY UNIVERSITY (JP) | 2015-12-08 | — | — | US | disclosed |
| US-8183270-B2 | Insecticidal N-substituted (2-substituted-1,3-thiazol)alkyl sulfoximines | DOW AGROSCIENCES, LLC (US) | 2012-05-22 | — | — | US | disclosed |
| US-20110060018-A1 | INSECTICIDAL N-SUBSTITUTED (2-SUBSTITUTED-1,3-THIAZOL)ALKYL SULFOXIMINES | CORTEVA AGRISCIENCE LLC | 2011-03-10 | — | — | US | disclosed |