⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6371601 | 0.62 | — | — | |
| SCHEMBL30040317 | 0.54 | — | — | |
| SCHEMBL7519557 | 0.53 | NISCH (0.31) | — | |
| SCHEMBL2497267 | 0.53 | — | — | |
| SCHEMBL12486426 | 0.53 | HTR2A (0.33) | — | |
| SCHEMBL419917 | 0.53 | CCR2 (0.31) | — | |
| SCHEMBL30132929 | 0.52 | — | — | |
| SCHEMBL27272436 | 0.52 | — | — | |
| SCHEMBL17826441 | 0.51 | — | — | |
| SCHEMBL22045780 | 0.51 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5194511-A | — | — | None | — | — | JP | disclosed |
| JP-H05194511-A | PYRAZOLE-RING ALKYLATED PYRAZOLOQUINOLINES | ELI LILLY & CO | 1993-08-03 | — | — | JP | disclosed |
| EP-0145121-B1 | PYRAZOLOQUINOLINES, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ELI LILLY AND COMPANY (US) | 1991-08-14 | — | — | EP | disclosed |
| US-4778894-A | TRANS-OCTAHYDROPYRAZOLOQUINOLINES; INTERMEDIATES FOR HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1988-10-18 | — | — | US | disclosed |
| US-4596871-A | Tautomeric mixtures | ELI LILLY AND COMPANY (US) | 1986-06-24 | — | — | US | disclosed |
| EP-0145121-A2 | Pyrazoloquinolines, process for their preparation, and pharmaceutical compositions containing them | ELI LILLY AND COMPANY (US) | 1985-06-19 | — | — | EP | disclosed |
| EP-0145121-A2 | Pyrazoloquinolines, process for their preparation, and pharmaceutical compositions containing them | ELI LILLY AND COMPANY (US) | 1985-06-19 | — | — | EP | disclosed |