⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6747801 | 0.70 | — | — | |
| SCHEMBL10727562 | 0.58 | — | — | |
| SCHEMBL24756417 | 0.54 | — | — | |
| SCHEMBL12743651 | 0.54 | — | — | |
| SCHEMBL10735274 | 0.54 | SLC6A4 (0.47) | — | |
| SCHEMBL19122081 | 0.54 | SLC6A4 (0.47) | — | |
| SCHEMBL24575158 | 0.54 | SLC6A4 (0.47) | — | |
| SCHEMBL7141827 | 0.53 | TSHR (0.40) | — | |
| SCHEMBL14826670 | 0.52 | SMN1; SMN2 (0.52) | — | |
| SCHEMBL9944702 | 0.51 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |