⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6632128 | 0.97 | ALOX15 (0.50) | — | |
| SCHEMBL12677450 | 0.82 | — | — | |
| SCHEMBL4421772 | 0.82 | — | — | |
| SCHEMBL4542330 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL7219443 | 0.80 | MAOA (0.48) | — | |
| SCHEMBL12128266 | 0.73 | — | — | |
| SCHEMBL15760642 | 0.71 | HRH3 (0.43) | — | |
| SCHEMBL179843 | 0.69 | ALOX15 (1.00) | — | |
| SCHEMBL3975418 | 0.69 | ALOX15 (1.00) | — | |
| SCHEMBL242967 | 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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3092901-B1 | QUINOLONE ANALOGS AND METHODS RELATED THERETO | SENHWA BIOSCIENCES INC (TW) | 2020-04-29 | — | — | EP | disclosed |
| US-9238657-B2 | Cephalosporin having catechol group | SHIONOGI & CO., LTD. (JP) | 2016-01-19 | — | — | US | disclosed |
| US-9238657-B2 | Cephalosporin having catechol group | SHIONOGI & CO., LTD. (JP) | 2016-01-19 | — | — | US | disclosed |
| EP-2341053-B1 | CEPHALOSPORIN HAVING CATECHOL GROUP | SHIONOGI & CO (JP) | 2016-01-13 | — | — | EP | disclosed |
| US-20110190254-A1 | CEPHALOSPORIN HAVING CATECHOL GROUP | SHIONOGI & CO., LTD. (JP) | 2011-08-04 | — | — | US | disclosed |
| US-20110190254-A1 | CEPHALOSPORIN HAVING CATECHOL GROUP | SHIONOGI & CO., LTD. (JP) | 2011-08-04 | — | — | US | disclosed |
| EP-2341053-A1 | CEPHALOSPORIN HAVING CATECHOL GROUP | Shionogi & Co., Ltd. (JP) | 2011-07-06 | — | — | EP | disclosed |
| US-5055569-A | Gastrointestinal disorders | G. D. SEARLE & CO. (US) | 1991-10-08 | — | — | US | disclosed |
| EP-0423777-A2 | Method of treating gastrointestinal motility disorders | G.D. Searle & Co. (US) | 1991-04-24 | — | — | EP | disclosed |
| EP-0423776-A2 | N-(6)-substituted adenosine compounds | G.D. Searle & Co. (US) | 1991-04-24 | — | — | EP | disclosed |