⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12181317 | 0.74 | — | — | |
| SCHEMBL18435480 | 0.69 | — | — | |
| SCHEMBL22779562 | 0.64 | — | — | |
| SCHEMBL23505973 | 0.62 | MAPT (0.35) | — | |
| SCHEMBL25094985 | 0.60 | — | — | |
| SCHEMBL23183267 | 0.58 | — | — | |
| SCHEMBL22744235 | 0.53 | — | — | |
| SCHEMBL7339712 | 0.53 | — | — | |
| SCHEMBL28286111 | 0.52 | — | — | |
| SCHEMBL2867963 | 0.52 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3286186-B1 | PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE MEMBERED RING HETEROCYLES | SYNGENTA PARTICIPATIONS AG (CH) | 2020-05-06 | — | — | EP | disclosed |