⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL27528968 | 0.97 | CYP19A1 (0.44) | — | |
| Aniline SCHEMBL28844237 | 0.82 | ALDH1A1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL5326601 | 0.80 | CYP19A1 (0.42) | — | |
| SCHEMBL5252228 | 0.78 | CYP19A1 (0.55) | — | |
| Ethylene SCHEMBL28777120 | 0.74 | CYP19A1 (0.50) | — | |
| SCHEMBL8327373 | 0.73 | ALDH1A1 (0.61) | — | |
| SCHEMBL8326938 | 0.73 | ALOX12 (0.61) | — | |
| SCHEMBL28376626 | 0.72 | — | — | |
| SCHEMBL7905747 | 0.71 | LMNA (0.55) | — | |
| SCHEMBL38181 | 0.70 | — | — |
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 457 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117229774-B | 5-Nitropyrimidine functionalized carbon dot fluorescent probe and preparation method and application thereof | 锦州医科大学 | 2025-06-17 | — | — | CN | claimed |
| CN-117229774-A | 5-nitropyrimidine functionalized carbon dot fluorescent probe and preparation method and application thereof | 锦州医科大学 | 2023-12-15 | — | — | CN | claimed |
| EP-3131914-B1 | 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV | IDENIX PHARMACEUTICALS LLC (US) | 2023-05-10 | — | — | EP | claimed |
| CN-113354589-A | Method for preparing 2,4-dichloro-5-nitropyrimidine | 南京麦瑞米生物技术有限公司 | 2021-09-07 | — | — | CN | claimed |
| CN-109293578-A | A kind of preparation method of the chloro- 5- nitro-pyrimidine of 2,4- bis- | 淮安万邦香料工业有限公司 | 2019-02-01 | — | — | CN | claimed |
| US-20180235993-A1 | METHODS AND COMPOSITIONS FOR TREATING FLAVIVIRUSES AND PESTIVIRUSES | IDENIX PHARMACEUTICALS LLC (US) | 2018-08-23 | — | — | US | claimed |
| US-9968628-B2 | Methods and compositions for treating flaviviruses and pestiviruses | IDENIX PHARMACEUTICALS LLC (US) | 2018-05-15 | — | — | US | claimed |
| EP-1534255-B1 | PROCESSES FOR PREPARING 1,3-DIOXOLANE NUCLEOSIDES | PHARMASSET INC (US) | 2011-01-19 | — | — | EP | claimed |
| CN-100427487-C | Synthesis of purine derivatives | HOFFMANN LA ROCHE (CH) | 2008-10-22 | — | — | CN | claimed |
| US-7230100-B2 | Stereoselective method for the preparation of nucleosides | SHIRE BIOCHEM., INC. (CA) | 2007-06-12 | — | — | US | claimed |
| EP-1315728-B1 | PROCESS FOR THE PREPARATION OF VITRONECTIN RECEPTOR ANTAGONISTS | AVENTIS PHARMA GMBH (DE) | 2004-10-27 | — | — | EP | claimed |
| US-20040034224-A1 | Synthesis of purine derivatives | ROCHE PALO ALTO LLC | 2004-02-19 | — | — | US | claimed |
| WO-2004002990-A2 | SYNTHESIS OF PURINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-08 | — | — | WO | claimed |
| EP-1315728-A1 | PROCESS FOR THE PREPARATION OF VITRONECTIN RECEPTOR ANTAGONISTS | Aventis Pharma Deutschland GmbH (DE) | 2003-06-04 | — | — | EP | claimed |
| WO-2002018384-A1 | PROCESS FOR THE PREPARATION OF VITRONECTIN RECEPTOR ANTAGONISTS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2002-03-07 | — | — | WO | claimed |
| CN-1151404-A | Substituted tetrahydro-5-nitro-pyrimidines | BAYER AG (DE) | 1997-06-11 | — | — | CN | claimed |
| US-4055411-A | 5-NITRO-PYRIMIDINES | CIBA-GEIGY CORPORATION (US) | 1977-10-25 | — | — | US | claimed |
| US-4014677-A | HERBICIDES | CIBA-GEIGY CORPORATION (US) | 1977-03-29 | — | — | US | claimed |
| US-3969101-A | 4,6-DIAMINO-5-NITRO-2-ALKYLTHIO-PYRIMIDINES | CIBA-GEIGY CORPORATION (US) | 1976-07-13 | — | — | US | claimed |
| US-3948914-A | PLANT GROWTH REGULATORS | CIBA-GEIGY CORPORATION (US) | 1976-04-06 | — | — | US | claimed |