⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9044558 | 0.78 | — | — | |
| SCHEMBL250367 | 0.76 | TAAR1 (0.46) | — | |
| SCHEMBL1523197 | 0.74 | — | — | |
| SCHEMBL9669161 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL29101971 | 0.74 | TAAR1 (0.45) | — | |
| SCHEMBL3605224 | 0.74 | — | — | |
| SCHEMBL4299008 | 0.74 | — | — | |
| SCHEMBL2288138 | 0.74 | — | — | |
| SCHEMBL9669167 | 0.72 | CYP3A4 (0.38) | — | |
| SCHEMBL23902837 | 0.72 | DPP4 (0.40) | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1422218-A1 | ANTIVIRAL AGENT | SHIONOGI & CO., LTD. (JP) | 2004-05-26 | — | — | EP | claimed |
| EP-0337255-A1 | Process for the preparation of 4-nitro-5-aminoimidazoles | BASF Aktiengesellschaft (DE) | 1989-10-18 | — | — | EP | claimed |
| US-11772085-B2 | Far superior oxidation catalysts based on macrocyclic compounds | CARNEGIE MELLON UNIVERSITY (US) | 2023-10-03 | — | — | US | disclosed |
| EP-4015511-A1 | OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS | CARNEGIE MELLON UNIVERSITY (US) | 2022-06-22 | — | — | EP | disclosed |
| EP-2584002-B1 | ACRYLIC RUBBER COMPOSITION, VULCANIZATE, HOSE PART, AND SEALING PART | DENKA COMPANY LTD (JP) | 2017-05-10 | — | — | EP | disclosed |
| EP-2266958-B1 | Antiviral agent | SHIONOGI & CO (JP) | 2017-03-15 | — | — | EP | disclosed |
| US-20170066754-A1 | ANTIVIRAL AGENT | SHIONOGI & CO., LTD. (JP) | 2017-03-09 | — | — | US | disclosed |
| US-9572813-B2 | Antiviral agent | SHIONOGI & CO., LTD. (JP) | 2017-02-21 | — | — | US | disclosed |
| EP-3042894-A1 | ANTIVIRAL AGENT | SHIONOGI & CO., LTD. (JP) | 2016-07-13 | — | — | EP | disclosed |
| US-20150352747-A1 | BLADDER FOR TIRE VULCANIZATION | DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 2015-12-10 | — | — | US | disclosed |
| EP-2946898-A1 | BLADDER FOR TIRE VULCANIZATION | Denki Kagaku Kogyo Kabushiki Kaisha (JP) | 2015-11-25 | — | — | EP | disclosed |
| US-20040229909-A1 | Antiviral agent | SHIONOGI & CO., LTD. (JP) | 2004-11-18 | — | — | US | disclosed |
| US-6794397-B2 | ANTICARCINOGENIC AGENTS | CYTOVIA, INC. | 2004-09-21 | — | — | US | disclosed |
| EP-1422218-A1 | ANTIVIRAL AGENT | SHIONOGI & CO., LTD. (JP) | 2004-05-26 | — | — | EP | disclosed |
| EP-1257536-A1 | SUBSTITUTED NICOTINAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF | Cytovia, Inc. (US) | 2002-11-20 | — | — | EP | disclosed |
| US-20020010185-A1 | Substituted nicotinamides and analogs as activators of caspases and inducers of apoptosis and the use thereof | CYTOVIA, INC. | 2002-01-24 | — | — | US | disclosed |
| WO-2001055115-A1 | SUBSTITUTED NICOTINAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF | CYTOVIA, INC. (US) | 2001-08-02 | — | — | WO | disclosed |
| EP-0337255-A1 | Process for the preparation of 4-nitro-5-aminoimidazoles | BASF Aktiengesellschaft (DE) | 1989-10-18 | — | — | EP | disclosed |
| EP-0337255-A1 | Process for the preparation of 4-nitro-5-aminoimidazoles | BASF Aktiengesellschaft (DE) | 1989-10-18 | — | — | EP | disclosed |
| EP-0337255-A1 | Process for the preparation of 4-nitro-5-aminoimidazoles | BASF Aktiengesellschaft (DE) | 1989-10-18 | — | — | EP | disclosed |