⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3559661 | 0.93 | FFAR4 (0.32) | — | |
| SCHEMBL1752338 | 0.82 | GABRP (0.39) | — | |
| SCHEMBL1752381 | 0.81 | GABRP (0.33) | — | |
| SCHEMBL1751409 | 0.80 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL3560242 | 0.79 | GABRP (0.33) | — | |
| SCHEMBL1752113 | 0.78 | GABRP (0.33) | — | |
| SCHEMBL3558058 | 0.78 | SLC34A1 (0.33) | — | |
| SCHEMBL3556487 | 0.78 | FFAR4 (0.33) | — | |
| SCHEMBL1751986 | 0.77 | GABRP (0.33) | — | |
| SCHEMBL1752330 | 0.76 | KDM4E (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7645786-B2 | 1-aryl-4-cyclopropylpyrazoles with at least one fluorine attached to the cyclopropyl ring; parasiticides; fleas; extended duration of action for at least 28 days | PFIZER INC. (US) | 2010-01-12 | — | — | US | disclosed |
| US-20080176865-A1 | SUBSTITUTED ARYLPYRAZOLES | PFIZER LIMITED (GB) | 2008-07-24 | — | — | US | disclosed |
| US-20070149550-A1 | 1-aryl-4-cyclopropylpyrazoles with at least one fluorine attached to the cyclopropyl ring; parasiticides; fleas; extended duration of action for at least 28 days | PFIZER INC. (US) | 2007-06-28 | — | — | US | disclosed |