⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL304288 | 0.67 | — | — | |
| SCHEMBL3388050 | 0.67 | — | — | |
| SCHEMBL8744314 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL8131222 | 0.64 | — | — | |
| SCHEMBL15233589 | 0.64 | — | — | |
| SCHEMBL8744346 | 0.62 | — | — | |
| SCHEMBL9892490 | 0.61 | — | — | |
| SCHEMBL7556186 | 0.61 | — | — | |
| SCHEMBL9512452 | 0.61 | — | — | |
| SCHEMBL1123886 | 0.61 | — | — |
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-2001019820-A1 | SUBSTITUTED PYRAZOL-3-YLBENZOXAZINONES | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-22 | — | — | WO | disclosed |