⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15532591 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL15532502 | 0.84 | — | — | |
| SCHEMBL15532594 | 0.84 | RXFP1 (0.33) | — | |
| SCHEMBL15532707 | 0.82 | EGLN2 (0.34) | — | |
| SCHEMBL855478 | 0.81 | PSD (0.30) | — | |
| SCHEMBL3749108 | 0.81 | NPC1 (0.37) | — | |
| SCHEMBL15532712 | 0.80 | CGAS (0.32) | — | |
| SCHEMBL926272 | 0.78 | TAAR1 (0.35) | — | |
| SCHEMBL926493 | 0.78 | KCNJ6 (0.30) | — | |
| SCHEMBL10264183 | 0.77 | KIF11 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9073912-B2 | Azetidine derivatives as antiparasitic agents | ZOETIS SERVICES LLC (US) | 2015-07-07 | — | — | US | disclosed |
| US-20150119377-A1 | AZETIDINE DERIVATIVES AS ANTIPARASITIC AGENTS | ZOETIS SERVICES LLC | 2015-04-30 | — | — | US | disclosed |