⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17918945 | 1.00 | — | — | |
| SCHEMBL27388902 | 0.84 | TSHR (0.40) | — | |
| SCHEMBL22027595 | 0.83 | TSHR (0.44) | — | |
| SCHEMBL598768 | 0.83 | TSHR (0.44) | — | |
| SCHEMBL3716399 | 0.82 | ALDH1A1 (0.50) | — | |
| SCHEMBL26405891 | 0.82 | ALDH1A1 (0.50) | — | |
| SCHEMBL14252439 | 0.82 | ALDH1A1 (0.50) | — | |
| SCHEMBL25472423 | 0.81 | METAP1 (0.41) | — | |
| SCHEMBL21207794 | 0.81 | METAP1 (0.41) | — | |
| SCHEMBL637507 | 0.79 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4603530-A1 | A FILM WITH IMPROVED THERMOFORMABILITY AND BARRIER PROPERTIES | Borealis GmbH (AT) | 2025-08-20 | — | — | EP | claimed |
| EP-4603530-A1 | A FILM WITH IMPROVED THERMOFORMABILITY AND BARRIER PROPERTIES | Borealis GmbH (AT) | 2025-08-20 | — | — | EP | disclosed |
| EP-3820846-B1 | COMPOSITION FOR INHIBITING MONOMER POLYMERIZATION COMPRISING A NITROXIDE INHIBITOR, A QUINONE METHIDE RETARDER AND AN AMINE STABILIZER | ECOLAB USA INC (US) | 2024-01-03 | — | — | EP | disclosed |
| US-11471681-B2 | Batteryless implantable microstimulators | SETPOINT MEDICAL CORPORATION (US) | 2022-10-18 | — | — | US | disclosed |
| US-11180578-B2 | Polymerization inhibitor and retarder compositions with amine stabilizer | ECOLAB USA INC. (US) | 2021-11-23 | — | — | US | disclosed |
| CN-112533902-A | Compositions comprising nitroxide inhibitors, quinone methide blockers and amine stabilizers to inhibit polymerization of monomers | 埃科莱布美国股份有限公司 | 2021-03-19 | — | — | CN | disclosed |
| US-9559102-B2 | Semiconductor device | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2017-01-31 | — | — | US | disclosed |
| EP-1501361-B1 | 3-HETEROARYL SUBSTITUTED 5-METHYLOXYMETHYL ISOXAZOLINES USED AS HERBICIDES | BASF SE (DE) | 2009-09-30 | — | — | EP | disclosed |
| US-7381687-B2 | 3-heteroaryl substituted 5-methyloxymethyl isoxazolines used as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2008-06-03 | — | — | US | disclosed |
| US-20050165020-A1 | 3-heteroaryl substituted 5-methyloxymethyl isoxazolines used as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-28 | — | — | US | disclosed |
| CN-1054849-C | Preparation of quaternized aminoacetonitriles | BASF AG (DE) | 2000-07-26 | — | — | CN | disclosed |
| US-5763639-A | REACTION OF AMINE WITH (DI)ALDEHYDE, HYDROCYANIC ACID OR ALKALI METAL CYANIDE, QUATERNIZATION WITH ALKYLATING AGENT | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-09 | — | — | US | disclosed |
| CN-1159802-A | Process for producing quaternary glycine nitriles | BASF AG (DE) | 1997-09-17 | — | — | CN | disclosed |
| US-4113764-A | Manufacture of N-substituted glycinonitriles | BASF AKTIENGESELLSCHAFT (DE) | 1978-09-12 | — | — | US | disclosed |
| US-4083849-A | Process for preparation of 5-cyanopyrid-6-ones | BASF AKTIENGESELLSCHAFT (DT) | 1978-04-11 | — | — | US | disclosed |
| US-4022815-A | Manufacture of substituted glycinonitriles | BASF AKTIENGESELLSCHAFT (DT) | 1977-05-10 | — | — | US | disclosed |