⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9533605 | 0.97 | EPHX1 (0.56) | — | |
| SCHEMBL9532822 | 0.97 | EPHX1 (0.56) | — | |
| SCHEMBL9169691 | 0.97 | EPHX1 (0.50) | — | |
| SCHEMBL10341251 | 0.97 | EPHX1 (0.56) | — | |
| SCHEMBL3617139 | 0.97 | EPHX1 (0.56) | — | |
| SCHEMBL11098408 | 0.97 | EPHX1 (0.56) | — | |
| SCHEMBL9175843 | 0.97 | EPHX1 (0.50) | — | |
| SCHEMBL28066445 | 0.95 | EPHX1 (0.54) | — | |
| SCHEMBL1730483 | 0.93 | EPHX1 (0.46) | — | |
| SCHEMBL689159 | 0.92 | — | — |
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 120 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114502179-A | Method for preparing aqueous formulations containing manganese complexes, formulations and methods of treatment | 加莱拉实验室有限责任公司 | 2022-05-13 | — | — | CN | claimed |
| CN-111902147-A | Combination cancer therapy of pentaazamacrocycle complexes and platinum-based anticancer agents | 加莱拉实验室有限责任公司 | 2020-11-06 | — | — | CN | claimed |
| WO-2010012793-A1 | FUNGICIDE AMINOTHIAZOLE DERIVATIVES | BAYER CROPSCIENCE SA (FR) | 2010-02-04 | — | — | WO | claimed |
| US-7196108-B2 | Bicyclic heterocycles for the treatment of diabetes and other diseases | INCYTE SAN DIEGO INC. (US) | 2007-03-27 | — | — | US | claimed |
| US-20060160796-A1 | N-substituted heterocycles for the treatment of hypercholesteremia, dyslipidemia and other metabolic disorders; cancer, and other diseases | PFAHL MAGNUS | 2006-07-20 | — | — | US | claimed |
| EP-1487446-A4 | BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES | INCYTE SAN DIEGO INC (US) | 2006-04-19 | — | — | EP | claimed |
| EP-1487446-A2 | BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES | Incyte San Diego, Inc. (US) | 2004-12-22 | — | — | EP | claimed |
| US-20040034004-A1 | Bicyclic heterocycles for the treatment of diabetes and other diseases | ORTHO MCNEIL PHARMACEUTICAL INC. | 2004-02-19 | — | — | US | claimed |
| WO-2003075858-A2 | BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES | INCYTE SAN DIEGO INCORPORATED (US) | 2003-09-18 | — | — | WO | claimed |
| EP-1042282-A1 | METHOD FOR PREPARING AROMATIC THIOLS AND DERIVATIVES, REAGENTS, INTERMEDIATE PRODUCTS AND METHOD FOR OBTAINING THEM | RHODIA CHIMIE (FR) | 2000-10-11 | — | — | EP | claimed |
| CN-1191530-A | Manganese or iron complexes of nitrogen-contg. macrocyclic ligands effective as catalysts for dismutating superoxide | MONSANTO CO (US) | 1998-08-26 | — | — | CN | claimed |
| EP-0598753-B1 | MANGANESE COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE | MONSANTO CO (US) | 1998-03-18 | — | — | EP | claimed |
| EP-0586585-A4 | — | — | 1994-08-31 | — | — | EP | claimed |
| EP-0586585-A1 | 1,2-DIHYDROPYRIDO(3,4-B)PYRAZINES AS FUNGICIDES | SOUTHERN RESEARCH INSTITUTE (US) | 1994-03-16 | — | — | EP | claimed |
| EP-0405233-B1 | Diphenylurea derivatives | MITSUBISHI CHEM IND (JP) | 1993-10-27 | — | — | EP | claimed |
| WO-1992020680-A1 | 1,2-DIHYDROPYRIDO(3,4-B)PYRAZINES AS FUNGICIDES | SOUTHERN RESEARCH INSTITUTE (US) | 1992-11-26 | — | — | WO | claimed |
| US-5095017-A | 1,2-dihydropyrido(3,4,-b)pyrazines as fungicides | SOUTHERN RESEARCH INSTITUTE (US) | 1992-03-10 | — | — | US | claimed |
| EP-0405233-A1 | Diphenylurea derivatives | MITSUBISHI KASEI CORPORATION (JP) | 1991-01-02 | — | — | EP | claimed |
| EP-0000640-B1 | TETRAHYDRO-S-TRIAZINE THIONES, PROCESS FOR THEIR PREPARATION AND ACARICIDAL COMPOSITIONS CONTAINING THEM. | Pfizer Limited (GB) | 1981-06-03 | — | — | EP | claimed |
| EP-0000640-A1 | Tetrahydro-s-triazine thiones, process for their preparation and acaricidal compositions containing them. | Pfizer Limited (GB) | 1979-02-07 | — | — | EP | claimed |