⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6765313 | 0.87 | — | — | |
| SCHEMBL355260 | 0.82 | — | — | |
| SCHEMBL80556 | 0.82 | — | — | |
| SCHEMBL2327959 | 0.82 | — | — | |
| SCHEMBL1883443 | 0.82 | — | — | |
| SCHEMBL9816809 | 0.82 | — | — | |
| SCHEMBL542125 | 0.82 | — | — | |
| SCHEMBL6048097 | 0.82 | — | — | |
| SCHEMBL6765401 | 0.78 | — | — | |
| SCHEMBL6541708 | 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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1229014-B1 | Purification process for arylcarboxylic acids | ALBEMARLE CORP (US) | 2004-08-11 | — | — | EP | disclosed |
| EP-1394141-A1 | Preparation of aryl olefins | ALBEMARLE CORPORATION (US) | 2004-03-03 | — | — | EP | disclosed |
| EP-0961765-B1 | PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES | ALBEMARLE CORP (US) | 2003-07-09 | — | — | EP | disclosed |
| EP-0961763-B1 | PREPARATION OF OLEFINIC COMPOUNDS AND CARBOXYLIC DERIVATIVES THEREOF | ALBEMARLE CORP (US) | 2003-04-02 | — | — | EP | disclosed |
| EP-1229014-A1 | Purification process for arylcarboxylic acids | ALBEMARLE CORPORATION (US) | 2002-08-07 | — | — | EP | disclosed |
| EP-1025074-A1 | RECOVERY AND RECYCLE OF CATALYST COMPONENTS USED IN PALLADIUM-CATALYZED PREPARATION OF ARYLCARBOXYLIC ACIDS | ALBEMARLE CORPORATION (US) | 2000-08-09 | — | — | EP | disclosed |
| US-6096920-A | LARGE-SCALE PRODUCTION OF CERTAIN AROMATICALLY-SUBSTITUTED ALIPHATIC CARBOXYLIC ACIDS AND THEIR ACID DERIVATIVES | ALBEMARLE CORPORATION (US) | 2000-08-01 | — | — | US | disclosed |
| US-6080888-A | REACTING ARYL HALIDE WITH AN OLEFINIC COMPOUND IN THE PRESENCE OF A POLAR LIQUID REACTION MEDIUM CONTAINING A SECONDARY OR TERTIARY AMINE AS A HYDROGEN HALIDE ACCEPTOR, A CATALYST SYSTEM FORMED FROM PALLADIUM, A PHOSPHINE | ALBEMARLE CORPORATION (US) | 2000-06-27 | — | — | US | disclosed |
| EP-0961763-A1 | PREPARATION OF OLEFINIC COMPOUNDS AND CARBOXYLIC DERIVATIVES THEREOF | ALBEMARLE CORPORATION (US) | 1999-12-08 | — | — | EP | disclosed |
| EP-0961765-A2 | PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES | ALBEMARLE CORPORATION (US) | 1999-12-08 | — | — | EP | disclosed |
| WO-1999019289-A1 | RECOVERY AND RECYCLE OF CATALYST COMPONENTS USED IN PALLADIUM-CATALYZED PREPARATION OF ARYLCARBOXYLIC ACIDS | ALBEMARLE CORPORATION (US) | 1999-04-22 | — | — | WO | disclosed |
| WO-1998030522-A1 | PREPARATION OF OLEFINIC COMPOUNDS AND CARBOXYLIC DERIVATIVES THEREOF | ALBEMARLE CORPORATION (US) | 1998-07-16 | — | — | WO | disclosed |
| WO-1998030529-A2 | PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES | ALBEMARLE CORPORATION (US) | 1998-07-16 | — | — | WO | disclosed |