⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6025039 | 0.78 | CCNB2 (0.30) | — | |
| SCHEMBL6025605 | 0.75 | — | — | |
| SCHEMBL6024001 | 0.73 | — | — | |
| SCHEMBL6023827 | 0.69 | CFTR (0.31) | — | |
| SCHEMBL22516585 | 0.67 | MET (0.40) | — | |
| SCHEMBL16590513 | 0.67 | TAAR1 (0.39) | — | |
| SCHEMBL3236614 | 0.64 | GABRA1 (0.31) | — | |
| SCHEMBL28477387 | 0.63 | — | — | |
| SCHEMBL180192 | 0.62 | — | — | |
| SCHEMBL25186034 | 0.62 | CSNK2A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0880523-B1 | PYRAZOLOPYRIMIDINES AS CRF RECEPTOR ANTAGONISTS | NEUROCRINE BIOSCIENCES INC (US) | 2006-08-16 | — | — | EP | disclosed |
| EP-0880523-A1 | PYRAZOLOPYRIMIDINES AS CRF RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1998-12-02 | — | — | EP | disclosed |
| WO-1997029109-A1 | PYRAZOLOPYRIMIDINES AS CRF RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-08-14 | — | — | WO | disclosed |