⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL108375 | 0.79 | — | — | |
| Propionic Acid SCHEMBL1194731 | 0.72 | FFAR3 (0.53) | — | |
| SCHEMBL30831806 | 0.72 | FFAR3 (0.47) | — | |
| SCHEMBL13009507 | 0.72 | FFAR3 (0.47) | — | |
| SCHEMBL10371506 | 0.72 | — | — | |
| SCHEMBL23131 | 0.70 | — | — | |
| 2,3-Pentanedione SCHEMBL106990 | 0.69 | — | — | |
| SCHEMBL14196384 | 0.69 | ALDH1A1 (0.53) | — | |
| 2,3-Pentanedione SCHEMBL1514922 | 0.69 | ALDH1A1 (0.53) | — | |
| Potassium Ion SCHEMBL3483407 | 0.69 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047431-B1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE THEREOF | TUFTS COLLEGE (US) | 2012-12-12 | — | — | EP | claimed |
| US-20050250744-A1 | Pharmaceutically active compounds and methods of use thereof | TRUSTEES OF TUFTS COLLEGE (US) | 2005-11-10 | — | — | US | claimed |
| EP-1047431-A4 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE THEREOF | TUFTS COLLEGE (US) | 2004-12-08 | — | — | EP | claimed |
| US-20040152674-A1 | Pharmaceutically active compounds and methods of use thereof | TRUSTEES OF TUFTS COLLEGE (US) | 2004-08-05 | — | — | US | claimed |
| US-20020123637-A1 | 5,9-substituted tetracycline; antibacterial activity, including against both gram-positive and gram-negative bacteria | TRUSTEES OF TUFTS COLLEGE | 2002-09-05 | — | — | US | claimed |
| EP-1047431-A1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE THEREOF | TRUSTEES OF TUFTS COLLEGE (US) | 2000-11-02 | — | — | EP | claimed |
| WO-1999037306-A1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE THEREOF | TRUSTEES OF TUFTS COLLEGE (US) | 1999-07-29 | — | — | WO | claimed |
| WO-1999037307-A1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE THEREOF | TRUSTEES OF TUFTS COLLEGE (US) | 1999-07-29 | — | — | WO | claimed |
| US-20040092737-A1 | Benzopiperidine derivatives | EISAI CO., LTD. | 2004-05-13 | — | — | US | disclosed |
| US-6518423-B1 | These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and | EISAI CO., LTD. (JP) | 2003-02-11 | — | — | US | disclosed |
| EP-0934941-A1 | BENZOPIPERIDINE DERIVATIVES | Eisai Co., Ltd. (JP) | 1999-08-11 | — | — | EP | disclosed |
| US-4960908-A | ANTIBODY INHIBITOR AND ANTICARCINOGENIC AGENT | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1990-10-02 | — | — | US | disclosed |
| US-4841077-A | Isoflavone derivatives, and salts thereof, and cancerocidal and immunosuppressive agents containing the same | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1989-06-20 | — | — | US | disclosed |
| EP-0245518-A1 | ISOFLAVONE DERIVATIVES, SALTS THEREOF, AND ONCOSTATIC AND IMMUNOSUPPRESSIVE AGENTS | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1987-11-19 | — | — | EP | disclosed |