⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11511389 | 0.92 | CA1 (0.50) | — | |
| SCHEMBL11155659 | 0.83 | — | — | |
| SCHEMBL923333 | 0.83 | FNTA (0.45) | — | |
| SCHEMBL3640927 | 0.83 | CA2 (0.50) | — | |
| SCHEMBL5081398 | 0.82 | — | — | |
| SCHEMBL8641224 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL16914769 | 0.81 | — | — | |
| SCHEMBL17456416 | 0.80 | FNTA (0.48) | — | |
| SCHEMBL5788200 | 0.80 | FNTA (0.53) | — | |
| SCHEMBL721222 | 0.80 | FNTA (0.53) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4145264-A | AROMATIC O-DICARBOXYLIC ACID NITRILES ELECTROLYZED IN AN ORGANIC LIQUID WITH AN ALKALINE ACTIVATOR | BASF AKTIENGESELLSCHAFT (DE) | 1979-03-20 | — | — | US | claimed |
| US-20100159393-A1 | METHOD OF DEVELOPING LITHOGRAPHIC PRINTING PLATE PRECURSORS | KODAK GRAPHIC COMMUNICATIONS, GMBH (DE) | 2010-06-24 | — | — | US | disclosed |
| EP-1922589-A2 | METHOD OF DEVELOPING LITHOGRAPHIC PRINTING PLATE PRECURSORS | Kodak Polychrome Graphics GmbH (DE) | 2008-05-21 | — | — | EP | disclosed |
| WO-2007023336-A2 | METHOD OF DEVELOPING LITHOGRAPHIC PRINTING PLATE PRECURSORS | KODAK POLYCHROME GRAPHICS GMBH (DE) | 2007-03-01 | — | — | WO | disclosed |
| US-4145264-A | AROMATIC O-DICARBOXYLIC ACID NITRILES ELECTROLYZED IN AN ORGANIC LIQUID WITH AN ALKALINE ACTIVATOR | BASF AKTIENGESELLSCHAFT (DE) | 1979-03-20 | — | — | US | disclosed |