⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6900504 | 0.82 | — | — | |
| SCHEMBL140720 | 0.82 | — | — | |
| SCHEMBL29526571 | 0.82 | — | — | |
| SCHEMBL16012968 | 0.82 | — | — | |
| SCHEMBL8861761 | 0.82 | — | — | |
| SCHEMBL8003463 | 0.82 | — | — | |
| SCHEMBL8656412 | 0.82 | — | — | |
| SCHEMBL30789351 | 0.82 | — | — | |
| SCHEMBL23398337 | 0.67 | — | — | |
| SCHEMBL6688816 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1167335-B1 | Process for producing aromatic polycarboxylic acid | MITSUBISHI GAS CHEMICAL CO (JP) | 2004-04-07 | — | — | EP | disclosed |
| US-6458994-B2 | LIQUID PHASE OXIDATION OF POLYALKYL-SUBSTITUTED AROMATIC ALDEHYDE AND/OR OXIDE DERIVATIVE IN WATER SOLVENT IN PRESENCE OF CATALYST OF BROMINE AND HEAVY METAL, PRODUCING TRIMELLITIC OR PYROMELLITIC ACID; CONTINUOUS/BATCH PROCESSING | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2002-10-01 | — | — | US | disclosed |
| US-20020016501-A1 | Process for producing aromatic polycarboxylic acid | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2002-02-07 | — | — | US | disclosed |
| EP-1167335-A2 | Process for producing aromatic polycarboxylic acid | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2002-01-02 | — | — | EP | disclosed |