⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16225029 | 1.00 | — | — | |
| SCHEMBL26316536 | 0.78 | — | — | |
| SCHEMBL9246735 | 0.78 | — | — | |
| SCHEMBL16802066 | 0.73 | TSHR (0.37) | — | |
| SCHEMBL11304728 | 0.73 | — | — | |
| SCHEMBL15304129 | 0.71 | OPRM1 (0.42) | — | |
| SCHEMBL7161450 | 0.71 | — | — | |
| SCHEMBL5798207 | 0.71 | — | — | |
| SCHEMBL12196256 | 0.71 | — | — | |
| SCHEMBL3667167 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130053246-A1 | SOYBEAN EVENT 3560.4.3.5 AND COMPOSITIONS AND METHODS FOR THE IDENTIFICATION AND/OR DETECTION THEREOF | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2013-02-28 | — | — | US | disclosed |