SCHEMBL427571

SCHEMBL427571

C=CC[S+](CC=C)CC=C.F[B-](F)(F)F

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
SCHEMBL290157 0.86 TSHR (0.33)
Iodide SCHEMBL10628089 0.82 TSHR (0.31)
SCHEMBL5586588 0.82 TSHR (0.31)
Water SCHEMBL247719 0.82 TSHR (0.31)
Hydrochloric Acid SCHEMBL3259945 0.82 TSHR (0.31)
Fluoride SCHEMBL5586586 0.76
Fluoride SCHEMBL5586589 0.76
SCHEMBL11764335 0.75
SCHEMBL7181499 0.75
Sulfuric Acid SCHEMBL11010650 0.69 CA5A (0.35)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116134108-A Room temperature stable conductive 1K epoxy formulations 汉高股份有限及两合公司 2023-05-16 CN claimed
US-8101749-B2 Process for the preparation of onium salts with a tetrafluoroborate anion having a reduced halide content MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-01-24 US claimed
EP-1831179-B1 METHOD FOR THE PRODUCTION OF ONIUM SALTS WITH TETRAFLUOROBORATE ANION HAVING A REDUCED HALIDE CONTENT MERCK PATENT GMBH (DE) 2010-11-03 EP claimed
US-20090253912-A1 PROCESS FOR THE PREPARATION OF ONIUM SALTS WITH A TETRAFLUOROBORATE ANION HAVING A REDUCED HALIDE CONTENT MERCK PATENT GMBH (DE) 2009-10-08 US claimed
CN-116134108-A Room temperature stable conductive 1K epoxy formulations 汉高股份有限及两合公司 2023-05-16 CN disclosed
US-8101749-B2 Process for the preparation of onium salts with a tetrafluoroborate anion having a reduced halide content MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-01-24 US disclosed
US-20090253912-A1 PROCESS FOR THE PREPARATION OF ONIUM SALTS WITH A TETRAFLUOROBORATE ANION HAVING A REDUCED HALIDE CONTENT MERCK PATENT GMBH (DE) 2009-10-08 US disclosed
US-4002742-A 1-N-alkyl-4,6-di-(aminoglycosyl)-1,3-diaminocyclitols, methods for their manufacture, methods for their use as antibacterial agents, and compositions useful therefor SCHERING CORPORATION (US) 1977-01-11 US disclosed
US-4000261-A 5-EPI-4,6-DI-O-(AMINOGLYCOSYL)-2-DEOXYSTREPTAMINES, METHODS FOR THEIR MANUFACTURE AND INTERMEDIATES USEFUL THEREIN, METHODS FOR THEIR USE AS ANTIBACTERIAL AGENTS AND COMPOSITIONS USEFUL THEREFOR SCHERING CORPORATION (US) 1976-12-28 US disclosed
US-4000262-A 5-EPI-AMINO AND 5-EPI-AZIDO-4,6-DI-O-(AMINOGLYCOSYL)-2,5-DIDEOXYSTREPTAMINES 1-N-ALKYL-5-EPI-AMINO AND 1-N-ALKYL-5-EPI-AZIDO-4,6-DI-O-(AMINOGLYCOSYL)-2,5-DIDEOXYSTREPTAMINES SCHERING CORPORATION (US) 1976-12-28 US disclosed