⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1645830 | 0.81 | — | — | |
| SCHEMBL3435474 | 0.80 | MEN1 (0.41) | — | |
| SCHEMBL32668764 | 0.77 | — | — | |
| SCHEMBL16080807 | 0.77 | TDP1 (0.55) | — | |
| SCHEMBL430122 | 0.77 | — | — | |
| SCHEMBL32668658 | 0.77 | — | — | |
| SCHEMBL30076415 | 0.77 | TDP1 (0.50) | — | |
| SCHEMBL3936310 | 0.77 | TDP1 (0.50) | — | |
| SCHEMBL3936312 | 0.77 | TDP1 (0.50) | — | |
| SCHEMBL343213 | 0.76 | — | — |
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-9125406-B2 | Methods and compositions for control of cabbage looper, trichoplusia ni | SIMON FRASER UNIVERSITY (CA) | 2015-09-08 | — | — | US | disclosed |
| US-20130131185-A1 | Methods and Compositions for Control of Cabbage Looper, Trichoplusia ni | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2013-05-23 | — | — | US | disclosed |
| US-20100160451-A1 | METHODS AND COMPOSITIONS FOR CONTROL OF CABBAGE LOOPER, Trichoplusia ni | SIMON FRASER UNIVERSITY (CA) | 2010-06-24 | — | — | US | disclosed |