⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18900801 | 0.66 | — | — | |
| SCHEMBL16601194 | 0.63 | — | — | |
| SCHEMBL16085018 | 0.58 | — | — | |
| SCHEMBL978834 | 0.58 | — | — | |
| SCHEMBL19975588 | 0.57 | — | — | |
| SCHEMBL14221469 | 0.57 | — | — | |
| SCHEMBL11002095 | 0.55 | — | — | |
| SCHEMBL11796535 | 0.55 | GABBR2 (0.33) | — | |
| SCHEMBL10482577 | 0.55 | GABBR2 (0.33) | — | |
| SCHEMBL23838513 | 0.54 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016180843-A1 | NEW 5,8-DIMETHYL-9-PHENYL-5,8-DIHYDRO-6H-PYRAZOLO[3,4-H]QUINAZOLIN-2- YL)-(1 H-PYRAZOL-3-YL)-AMINES AND DERIVATIVES AS IGF-1 R/IR INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2016-11-17 | — | — | WO | disclosed |