⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17636435 | 1.00 | — | — | |
| SCHEMBL21337573 | 0.85 | — | — | |
| SCHEMBL18659501 | 0.85 | — | — | |
| SCHEMBL790117 | 0.72 | — | — | |
| SCHEMBL22618127 | 0.72 | — | — | |
| SCHEMBL25014315 | 0.72 | — | — | |
| SCHEMBL789262 | 0.72 | — | — | |
| SCHEMBL14342680 | 0.72 | — | — | |
| SCHEMBL789263 | 0.72 | — | — | |
| SCHEMBL25014316 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120987779-A | Meta-toluenediamine composition, and purification method and application thereof | 万华化学(福建)异氰酸酯有限公司 | 2025-11-21 | — | — | CN | disclosed |
| US-20120121932-A1 | Molecular Layer Deposition Process For Making Organic Or Organic-Inorganic Polymers | AIR FORCE, UNITED STATES | 2012-05-17 | — | — | US | disclosed |