⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29881798 | 0.84 | — | — | |
| SCHEMBL1886952 | 0.84 | — | — | |
| SCHEMBL6022841 | 0.81 | — | — | |
| SCHEMBL2704999 | 0.78 | MAPT (0.47) | — | |
| SCHEMBL29881025 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL1888484 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL1769434 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL12663220 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL13651528 | 0.76 | — | — | |
| SCHEMBL1769397 | 0.76 | ALDH1A1 (0.48) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0738722-B1 | 5-Amino-benzofuran-2-carboxylic acid derivatives | MERCK PATENT GMBH (DE) | 2003-06-25 | — | — | EP | claimed |
| EP-0738722-A1 | 5-Amino-benzofuran-2-carboxylic acid derivatives | MERCK PATENT GmbH (DE) | 1996-10-23 | — | — | EP | claimed |
| EP-1233961-B9 | METHOD FOR PRODUCING 5-(1-PIPERAZINYL)-BENZOFURAN-2-CARBOXAMIDE BY TRANSITION METAL-CATALYZED AMINATION | MERCK PATENT GMBH (DE) | 2012-03-21 | — | — | EP | disclosed |
| EP-1215210-B1 | Benzofurans | MERCK PATENT GMBH (DE) | 2006-10-18 | — | — | EP | disclosed |
| EP-1233961-B1 | METHOD FOR PRODUCING 5-(1-PIPERAZINYL)-BENZOFURAN-2-CARBOXAMIDE BY TRANSITION METAL-CATALYZED AMINATION | MERCK PATENT GMBH (DE) | 2005-07-06 | — | — | EP | disclosed |
| EP-0738722-B1 | 5-Amino-benzofuran-2-carboxylic acid derivatives | MERCK PATENT GMBH (DE) | 2003-06-25 | — | — | EP | disclosed |
| EP-1233961-A2 | METHOD FOR PRODUCING 5-(1-PIPERAZINYL)-BENZOFURAN-2-CARBOXAMIDE BY TRANSITION METAL-CATALYZED AMINATION | MERCK PATENT GmbH (DE) | 2002-08-28 | — | — | EP | disclosed |
| EP-1215210-A2 | Benzofurans | MERCK PATENT GmbH (DE) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001040219-A2 | METHOD FOR PRODUCING 5-(1-PIPERAZINYL)-BENZOFURAN-2-CARBOXAMIDE BY TRANSITION METAL-CATALYZED AMINATION | MERCK PATENT GMBH (DE) | 2001-06-07 | — | — | WO | disclosed |
| EP-0738722-A1 | 5-Amino-benzofuran-2-carboxylic acid derivatives | MERCK PATENT GmbH (DE) | 1996-10-23 | — | — | EP | disclosed |