⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8554505 | 0.84 | GABRP (0.36) | — | |
| SCHEMBL8556749 | 0.81 | NOTUM (0.35) | — | |
| SCHEMBL8551679 | 0.76 | — | — | |
| SCHEMBL8550923 | 0.70 | GABRP (0.34) | — | |
| SCHEMBL8302829 | 0.69 | — | — | |
| SCHEMBL8555613 | 0.69 | GABRP (0.34) | — | |
| SCHEMBL8556152 | 0.69 | GABRP (0.34) | — | |
| SCHEMBL8551496 | 0.68 | NOTUM (0.34) | — | |
| SCHEMBL8551079 | 0.68 | GABRP (0.34) | — | |
| SCHEMBL8557118 | 0.66 | GABRB3 (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0871617-A1 | PARASITICIDAL COMPOUNDS | PFIZER INC. (US) | 1998-10-21 | — | — | EP | claimed |
| WO-1997007102-A1 | PARASITICIDAL COMPOUNDS | PFIZER INC (US) | 1997-02-27 | — | — | WO | claimed |
| EP-0871617-A1 | PARASITICIDAL COMPOUNDS | PFIZER INC. (US) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997007102-A1 | PARASITICIDAL COMPOUNDS | PFIZER INC (US) | 1997-02-27 | — | — | WO | disclosed |