SCHEMBL3922984

SCHEMBL3922984

FC(F)SCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
POLB P06746 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MAOB P27338 1/20 0.40
EPHX1 P07099 1/20 0.40
CALM1 P0DP23 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1467047 0.76 SLC6A2 (0.52) IDO1NOS3NOS1NOS2POLB
SCHEMBL10899765 0.75 L3MBTL1 (0.47) POLBPPARGPPARACYP1A2CYP3A4
SCHEMBL560907 0.75 PPARG (0.45) POLBPPARGPPARACYP1A2CYP3A4
SCHEMBL11234251 0.75 IDO1 (0.41) IDO1NOS3NOS1NOS2POLB
SCHEMBL10976269 0.75 IDO1 (0.41) IDO1NOS3NOS1NOS2POLB
Hydrochloric Acid SCHEMBL1466263 0.75 SLC6A2 (0.50) IDO1NOS3NOS1NOS2POLB
SCHEMBL6461635 0.73 EPHX1 (0.54) IDO1NOS3NOS1NOS2POLB
SCHEMBL23998029 0.71 TP53 (0.44) IDO1NOS3NOS1NOS2POLB
SCHEMBL7215558 0.71 PPARG (0.42) POLBCTSLCTSBCA12CA1
SCHEMBL4850434 0.71 PPARG (0.42) POLBHSD17B10PPARGPPARACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598777-A Preparation method of difluoromethane sulfonyl chloride 衢州市九洲化工有限公司 2024-09-06 CN claimed
CN-116063208-A Synthesis method of difluoromethane sulfonyl chloride 安徽省化工研究院 2023-05-05 CN claimed
CN-118598777-A Preparation method of difluoromethane sulfonyl chloride 衢州市九洲化工有限公司 2024-09-06 CN disclosed
CN-118598777-A Preparation method of difluoromethane sulfonyl chloride 衢州市九洲化工有限公司 2024-09-06 CN disclosed
CN-117049996-A Synthesis method of 3-difluoromethylthio substituted indole compound 都创(上海)医药科技股份有限公司 2023-11-14 CN disclosed
CN-116063208-A Synthesis method of difluoromethane sulfonyl chloride 安徽省化工研究院 2023-05-05 CN disclosed
CN-116063208-A Synthesis method of difluoromethane sulfonyl chloride 安徽省化工研究院 2023-05-05 CN disclosed
CN-107540598-B Method for preparing N-difluoromethylthio phthalimide compound 中国科学院上海有机化学研究所 2020-05-12 CN disclosed
CN-107540598-A A kind of method for preparing N difluoro methyl mercapto neighbour's benzoylimino class compounds 中国科学院上海有机化学研究所 2018-01-05 CN disclosed
CN-100509776-C Method for synthesis of hydrogenofluoromethylenesulphonyl radical derivatives RHONE POULENC CHIMIE (FR) 2009-07-08 CN disclosed
US-7534906-B2 Process for the synthesis of hydrogenofluoromethylenesulphonyl radical derivatives RHODIA CHIMIE (FR) 2009-05-19 US disclosed
CN-1671657-A Method for synthesis of hydrogenofluoromethylenesulphonyl radical derivatives RHONE POULENC CHIMIE (FR) 2005-09-21 CN disclosed
JP-2005112810-A METHOD FOR PRODUCING BENZYL(DIFLUOROMETHYL) SULFIDE COMPOUND IHARA CHEM IND CO LTD 2005-04-28 JP disclosed
JP-2003128644-A METHOD FOR PRODUCING BENZYL(DIFLUOROMETHYL)SULFIDE NIPPON NOHYAKU CO LTD 2003-05-08 JP disclosed
WO-2002066423-A1 PROCESS FOR PREPARATION OF POLYFLUOROALKYLSULFENYL COMPOUNDS NIHON NOHYAKU CO., LTD. (JP) 2002-08-29 WO disclosed
US-4529721-A Human and veterinary bactericide SHIONOGI & CO., LTD. (JP) 1985-07-16 US disclosed
EP-0107928-A1 Vinylthioacetamido oxacephalosporin derivatives, and intermediates therefor, their preparation, formulations containing the same and their antibacterial use SHIONOGI & CO., LTD. (JP) 1984-05-09 EP disclosed
EP-0008854-A1 Pentadienone hydrazone, and its use as insecticidal agent AMERICAN CYANAMID COMPANY (US) 1980-03-19 EP disclosed
US-4191768-A Pentadienone hydrazones, method for preparing the same, and insecticidal use thereof AMERICAN CYANAMID COMPANY (US) 1980-03-04 US disclosed
US-3932508-A Polyfluoromethylthio-substituted compounds MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-01-13 US disclosed