SCHEMBL539827

SCHEMBL539827

O=CNNC=O

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
Water SCHEMBL31612958 0.94
SCHEMBL11525868 0.78
SCHEMBL21857977 0.78
SCHEMBL15513739 0.78
SCHEMBL16127770 0.71
SCHEMBL2349173 0.71
SCHEMBL14686048 0.71
SCHEMBL6855556 0.71
SCHEMBL15047581 0.71
SCHEMBL30986704 0.71

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 647 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117343556-A Bio-based compound modified cracking carbon black and application thereof in tire preparation 中策橡胶集团股份有限公司 2024-01-05 CN claimed
CN-117327021-A Method for removing sticky impurities in hexahydropyridazine synthesis 河南豫辰药业股份有限公司 2024-01-02 CN claimed
CN-117247639-A Tire inner liner rubber composition containing bio-based modified cracking carbon black, mixing method and tire 中策橡胶集团股份有限公司 2023-12-19 CN claimed
CN-117247608-A Tire pad rubber composition containing bio-based modified cracking carbon black, mixing method and tire 中策橡胶集团股份有限公司 2023-12-19 CN claimed
CN-113354683-B Biphosphine ligand, preparation method and application thereof 万华化学集团股份有限公司 2023-05-30 CN claimed
EP-3428229-B1 CURABLE RESIN COMPOSITION, FUEL CELL, AND SEALING METHOD THREE BOND CO LTD (JP) 2022-08-17 EP claimed
US-11398630-B2 Method of generating energy from a hydrazide containing anode fuel, and fuel cell IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2022-07-26 US claimed
CN-113061335-A Environment-friendly flame-retardant building heat-insulating material and preparation method thereof 徐勇 2021-07-02 CN claimed
US-20210005900-A1 METHOD OF GENERATING ENERGY FROM A HYDRAZIDE CONTAINING ANODE FUEL, AND FUEL CELL IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2021-01-07 US claimed
US-10800952-B2 Curable resin composition, fuel cell, and sealing method THREEBOND CO., LTD. (JP) 2020-10-13 US claimed
EP-1520893-A1 High-rate barrier polishing composition Rohm and Haas Electronic Materials CMP Holdings, Inc. (US) 2005-04-06 EP claimed
US-20050066585-A1 High-rate barrier polishing composition ROHM AND HAAS ELECTRONIC MATERIALS CMP HOLDINGS, INC. 2005-03-31 US claimed
CN-85104392-A The preparation method of quinolone inotropic agents 1986-12-24 CN claimed
EP-0166533-A1 Quinolone inotropic agents Pfizer Limited (GB) 1986-01-02 EP claimed
EP-0027960-B1 PROCESS FOR THE PREPARATION OF 1,2,4-TRIAZOLE HOECHST AKTIENGESELLSCHAFT (DE) 1983-08-17 EP claimed
EP-0028723-B1 PROCESS FOR THE PREPARATION OF N,N'-DIFORMYL HYDRAZINE HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-26 EP claimed
US-4323705-A Process for the preparation of N,N'-diformylhydrazine HOECHST AKTIENGESELLSCHAFT (DE) 1982-04-06 US claimed
US-4283545-A Process for the preparation of 1,2,4-triazole HOECHST AKTIENGESELLSCHAFT (DE) 1981-08-11 US claimed
EP-0028723-A1 Process for the preparation of N,N'-diformyl hydrazine HOECHST AKTIENGESELLSCHAFT (DE) 1981-05-20 EP claimed
EP-0027960-A1 Process for the preparation of 1,2,4-triazole HOECHST AKTIENGESELLSCHAFT (DE) 1981-05-06 EP claimed