⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23529554 | 0.78 | — | — | |
| SCHEMBL5712391 | 0.76 | — | — | |
| SCHEMBL9021358 | 0.69 | — | — | |
| SCHEMBL988920 | 0.68 | LMNA (0.39) | — | |
| SCHEMBL6438507 | 0.65 | — | — | |
| SCHEMBL195749 | 0.63 | — | — | |
| SCHEMBL4281838 | 0.63 | — | — | |
| SCHEMBL4281835 | 0.63 | — | — | |
| SCHEMBL3839811 | 0.63 | — | — | |
| Ethane SCHEMBL8181219 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4351962-A | Process for the preparation of hydroxy benzene carboxaldehydes | RHONE POULENC INC. (US) | 1982-09-28 | — | — | US | disclosed |