⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28854334 | 1.00 | — | — | |
| SCHEMBL900705 | 0.74 | — | — | |
| SCHEMBL4201057 | 0.74 | LAP3 (0.30) | — | |
| SCHEMBL23335852 | 0.73 | — | — | |
| SCHEMBL436203 | 0.73 | — | — | |
| SCHEMBL11054901 | 0.71 | — | — | |
| SCHEMBL15255062 | 0.71 | — | — | |
| Isopropylamine SCHEMBL8424485 | 0.69 | TSHR (0.41) | — | |
| SCHEMBL28267105 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL11056768 | 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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025062996-A1 | CHEMICALLY-INDUCED DYNAMIC NUCLEAR POLARIZATION PROBE, COMPOUND, AND METHOD FOR EVALUATING CHEMICAL INDUCTION FUNCTION | 国立大学法人九州大学 | 2025-03-27 | — | — | WO | disclosed |
| CN-114569588-B | Chlorhexidine-vancomycin synergic targeting antibacterial application | 湖南大学 | 2023-09-26 | — | — | CN | disclosed |
| CN-114569588-A | Chlorhexidine-vancomycin cooperative targeting antibacterial application | 湖南大学 | 2022-06-03 | — | — | CN | disclosed |
| WO-2019143874-A1 | SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2019-07-25 | — | — | WO | disclosed |
| CN-104661518-B | Herbicidal combinations containing carboxylic acid of 4 amino, 3 chlorine 5 fluorine 6 (methoxyphenyl of 4 chlorine, 2 fluorine 3) pyridine 2 or derivatives thereof He clomazone | 美国陶氏益农公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-104661518-A | Herbicidal compositions comprising 4-amino-3-chloro-5-fluoro-6-(4-chloro-2-fluoro-3-methoxyphenyl) pyridine-2-carboxylic acid | DOW AGROSCIENCES LLC | 2015-05-27 | — | — | CN | disclosed |
| US-8623338-B2 | Methionine-derived peptidomimetics and their use in the protection of mitochondria of cutaneous cells | EXSYMOL S.A.M. (MC) | 2014-01-07 | — | — | US | disclosed |
| US-20120070394-A1 | METHIONINE-DERIVED PEPTIDOMIMETICS AND THEIR USE IN THE PROTECTION OF MITOCHONDRIA OF CUTANEOUS CELLS | EXSYMOL S.A.M. (MC) | 2012-03-22 | — | — | US | disclosed |
| US-20100009927-A1 | Anti-Inflammatory and Anti-Allergy Extracts from Nettle | HERBALSCIENCE GROUP LLC (US) | 2010-01-14 | — | — | US | disclosed |
| US-20090317326-A1 | RADIOFLUORINATION METHODS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2009-12-24 | — | — | US | disclosed |
| EP-0618221-A2 | Heterocyclic inhibitors of farnesyl protein transferase | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-10-05 | — | — | EP | disclosed |
| EP-0351058-B1 | PYRIMIDOPYRIMIDINE DERIVATIVES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-06-02 | — | — | EP | disclosed |
| US-5162316-A | Pyrimido[4,5-d]pyrimidine derivatives for use as bronchodilators | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1992-11-10 | — | — | US | disclosed |
| EP-0351058-A1 | Pyrimidopyrimidine derivatives | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1990-01-17 | — | — | EP | disclosed |
| US-4883911-A | Process for the preparation of alkylthioalkanoate salts | MONSANTO COMPANY (US) | 1989-11-28 | — | — | US | disclosed |
| US-4777289-A | Process for the preparation of alkylthioalkanoate salts | MONSANTO COMPANY (US) | 1988-10-11 | — | — | US | disclosed |
| EP-0245231-A1 | Process for the preparation of alkylthioalkanoate salts | Monsanto Company (US) | 1987-11-11 | — | — | EP | disclosed |
| EP-0056637-A1 | 4(3H)-quinazolinone derivatives, process for production thereof and pharmaceutical compositions comprising said compounds | Ishikawa, Masayuki (JP) | 1982-07-28 | — | — | EP | disclosed |
| US-4281123-A | Process for introducing three substituents in cyanuric chloride | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1981-07-28 | — | — | US | disclosed |
| US-4275203-A | Process for the production of chloro-amino-s-triazines | DEUTSCHE GOLD UND SILBER SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1981-06-23 | — | — | US | disclosed |