⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27550564 | 0.97 | HCAR2 (0.94) | — | |
| Hydrochloric Acid SCHEMBL6741706 | 0.97 | HCAR2 (0.94) | — | |
| Lithium SCHEMBL30194865 | 0.97 | HCAR2 (0.94) | — | |
| Formaldehyde SCHEMBL28203822 | 0.95 | HCAR2 (0.90) | — | |
| Formaldehyde SCHEMBL28213410 | 0.92 | HCAR2 (0.85) | — | |
| Urea SCHEMBL28229729 | 0.92 | HCAR2 (0.85) | — | |
| Methylamine SCHEMBL27659538 | 0.92 | HCAR2 (0.85) | — | |
| Trimethylammonium SCHEMBL27659537 | 0.90 | HCAR2 (0.81) | — | |
| Thiourea SCHEMBL29039143 | 0.88 | HCAR2 (0.77) | — | |
| Trifluoroacetic Acid SCHEMBL28310620 | 0.86 | HCAR2 (0.74) | — |
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
Appears in 2314 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2026106600-A1 | PROCESSES FOR MAKING STEEL PRODUCTS | ECOLAB USA INC. (US) | 2026-05-21 | — | — | WO | claimed |
| CN-115974758-B | Carboxymethyl ketone compound and preparation method thereof | 生物岛实验室 | 2025-06-10 | — | — | CN | claimed |
| EP-3873465-B1 | COMPOSITIONS AND METHODS FOR THE TREATMENT OF ADENOMYOSIS AND RECTOVAGINAL ENDOMETRIOSIS | KISSEI PHARMACEUTICAL (JP) | 2025-01-15 | — | — | EP | claimed |
| CN-115975324-B | Flexible mobile phone screen protection film and preparation method thereof | 深圳市华新龙纸品包装有限公司 | 2024-02-13 | — | — | CN | claimed |
| WO-2023229380-A1 | HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF | 주식회사 엘지화학 | 2023-11-30 | — | — | WO | claimed |
| CN-117050300-A | Polylysine-based polymer adjuvant material, and preparation method and application thereof | 中国科学院长春应用化学研究所 | 2023-11-14 | — | — | CN | claimed |
| CN-113943281-B | Synthetic method and application of isoxazole pyrimidine derivative | 深圳湾实验室 | 2023-08-15 | — | — | CN | claimed |
| CN-116178389-A | Preparation method of linagoli | 浙江科聚生物医药有限公司 | 2023-05-30 | — | — | CN | claimed |
| CN-115974758-A | Carboxymethyl ketone compound and preparation method thereof | 生物岛实验室 | 2023-04-18 | — | — | CN | claimed |
| WO-2023014022-A1 | PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT | 한국화학연구원 | 2023-02-09 | — | — | WO | claimed |
| WO-2006018284-A1 | COMPOUNDS AND COMPOSITIONS USEFUL AS CATHEPSIN S INHIBITORS | NOVARTIS AG (CH) | 2006-02-23 | — | — | WO | claimed |
| WO-2006015842-A1 | 4-PIPERAZINYL-PYRIMIDINE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR | ABBOTT GMBH & CO. KG (DE) | 2006-02-16 | — | — | WO | claimed |
| CN-1653077-A | Nucleoside derivatives for treating hepatitis C virus infection | GENELABS TECH INC (US) | 2005-08-10 | — | — | CN | claimed |
| EP-1515972-A1 | AMIDE SUBSTITUTED XANTHINE DERIVATIVES WITH GLUCONEOGENESIS MODULATING ACTIVITY | F. HOFFMANN-LA ROCHE AG (CH) | 2005-03-23 | — | — | EP | claimed |
| CN-1181057-C | Novel 5-pyrimidine carboxamide derivatives and the pharmaceutical compositions containing said derivatives | ����ҩƷ��ҵ��ʽ���� | 2004-12-22 | — | — | CN | claimed |
| US-6762189-B1 | HEPATITIS B VIRUS AND HUMAN IMMUNODEFICIENCY VIRUS ANTIPROLIFERATION AGENTS; REDUCED CHANCE OF TOXICITY, SIDE EFFECTS, AND DEVELOPMENT OF RESISTANT VIRAL STRAINS | DONG WHA PHARM. IND. CO., LTD. (KR) | 2004-07-13 | — | — | US | claimed |
| CN-1507447-A | Substituted pyrazolopyrimidines and thiazolopyrimidines | — | 2004-06-23 | — | — | CN | claimed |
| US-20040014766-A1 | Amide substituted xanthine derivatives | HOFFMANN-LA ROCHE INC. | 2004-01-22 | — | — | US | claimed |
| WO-2003106459-A1 | AMIDE SUBSTITUTED XANTHINE DERIVATIVES WITH GLUCONEOGENESIS MODULATING ACTIVITY | F. HOFFMANN-LA ROCHE AG (CH) | 2003-12-24 | — | — | WO | claimed |
| CN-1390203-A | Novel 5-pyrimidine carboxamide derivatives and the pharmaceutical compositions containing said derivatives | DONG WHA PHARM IND CO LTD (KR) | 2003-01-08 | — | — | CN | claimed |