⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20634515 | 0.86 | — | — | |
| SCHEMBL20610247 | 0.85 | ALOX5AP (0.31) | — | |
| SCHEMBL20610221 | 0.85 | CYP1A2 (0.32) | — | |
| SCHEMBL20610212 | 0.84 | — | — | |
| SCHEMBL20610205 | 0.84 | ALOX5AP (0.34) | — | |
| SCHEMBL17949562 | 0.83 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL20610201 | 0.81 | NPC1 (0.36) | — | |
| SCHEMBL17382576 | 0.79 | CA12 (0.32) | — | |
| SCHEMBL17383249 | 0.78 | LMNA (0.45) | — | |
| SCHEMBL17383123 | 0.78 | DDR1 (0.36) | — |
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-20200131177-A1 | PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS | SYNGENTA PARTICIPATIONS AG (CH) | 2020-04-30 | — | — | US | disclosed |
| US-20200131177-A1 | PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS | SYNGENTA PARTICIPATIONS AG (CH) | 2020-04-30 | — | — | US | disclosed |
| WO-2019008115-A1 | PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS | SYNGENTA PARTICIPATIONS AG (CH) | 2019-01-10 | — | — | WO | disclosed |