SCHEMBL2154643

SCHEMBL2154643

FC(F)(F)SCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
PRMT1 Q99873 1/20 0.52
IDO1 P14902 3/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
CES1 P23141 3/20 0.40
PTPN1 P18031 1/20 0.40
PTPRZ1 P23471 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAOB P27338 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

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
SCHEMBL22190423 0.87 TAAR1 (0.45) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL11262637 0.83 CYP1A2 (0.50) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL24191173 0.81 CYP1A2 (0.48) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL10655602 0.81 CYP1A2 (0.48) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL24191057 0.79 CYP1A2 (0.47) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL17761692 0.78 CES1 (0.50) CYP1A2CYP3A4CYP2D6NOS1CES1
SCHEMBL2059345 0.78 CYP1A2 (0.46) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL22190286 0.76 APP (0.39) CYP1A2CYP3A4CYP2D6PRMT1IDO1
SCHEMBL3355345 0.76 IDO1 (0.45) CYP1A2CYP3A4IDO1CYP2C19
SCHEMBL22190294 0.76 IDO1 (0.45) IDO1HSD17B10MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111087385-A Method for selectively synthesizing benzyl trifluoromethyl sulfide 南京大学 2020-05-01 CN claimed
CN-104267578-B A kind of sulfosalt class photo-acid agent containing fluorenes, preparation method and applications 同济大学 2017-12-05 CN claimed
US-9617207-B2 Method for preparation of perfluoroalkyl sulfenyl chloride Gharda Medical and Advanced Technologies Foundation (IN) 2017-04-11 US claimed
CN-105153330-B The double-branched light-sensitive compound of one class biphenyl type, preparation method and applications 同济大学 2017-04-05 CN claimed
EP-2521712-B1 METHOD FOR PREPARATION OF PERFLUOROMETHYLSULFENYL CHLORIDE GHARDA KEKI HORMUSJI (IN) 2016-12-14 EP claimed
US-20120296119-A1 METHOD FOR PREPARATION OF PERFLUOROALKYL SULFENYL CHLORIDE Gharda Medical and Advanced Technologies Foundation (IN) 2012-11-22 US claimed
EP-2521712-A1 A METHOD FOR PREPARATION OF PERFLUOROALKYL SULFENYL CHLORIDE Gharda, Keki Hormusji (IN) 2012-11-14 EP claimed
WO-2011080752-A1 A METHOD FOR PREPARATION OF PERFLUOROALKYL SULFENYL CHLORIDE GHARDA KEKI HORMUSJI (IN) 2011-07-07 WO claimed
EP-1000933-B1 TRIFLUORO METHYLTHIOMETHYL BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME IHARA CHEMICAL IND CO (JP) 2006-08-02 EP claimed
US-6225505-B1 BY REACTING BENZYL HALIDE DERIVATIVE WITH THIOPHOSGENE AND POTASSIUM FLUORIDE IN ACETONITRILE; HIGH YIELD AND PURITY WITHOUT USING OZONE LAYER-DESTROYING SUBSTANCE; USE AS INTERMEDIATE FOR DRUGS AND AGROCHEMICALS IHARA CHEMICAL INDUSTRY CO., LTD (JP) 2001-05-01 US claimed
EP-1000933-A1 TRIFLUORO METHYLTHIOMETHYL BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME Ihara Chemical Industry Co., Ltd. (JP) 2000-05-17 EP claimed
EP-0247953-B1 PROCESS FOR THE PREPARATION OF BENZYL-TRIFLUOROMETHYL SULFIDE RHONE-POULENC CHIMIE (FR) 1989-09-13 EP claimed
US-4788012-A Process for the preparation of benzyl trifluoromethyl sulfide RHONE-POULENC CHIMIE (FR) 1988-11-29 US claimed
CN-117720441-A Method for continuously preparing trifluoromethyl sulfonyl chloride 山东华安新材料有限公司 2024-03-19 CN disclosed
CN-117417531-A Cage polysilsesquioxane containing ethoxy and fluoro simultaneously and preparation method and application thereof 北京理工大学 2024-01-19 CN disclosed
CN-115724774-B Preparation method of trifluoromethyl sulfonyl chloride 山东华安新材料有限公司 2023-12-26 CN disclosed
US-4621125-A ADDITION POLYMERIZATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-11-04 US disclosed
EP-0164124-A2 Tris(disbustituted amino)sulfonium perfluoroalkoxides and perfluoroalkylmercaptides and process for their preparation E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-12-11 EP disclosed
US-4518596-A Antithrombotic use of 2-(perhydro-1,4-diazino)-pyrimido (5,4,D)-pyrimidines DR. KARL THOMAE GMBH (DE) 1985-05-21 US disclosed
US-4020169-A FROM ARYL IODIDE OR BROMIDE AND TRIFLUOROMETHYL THIO COPPER MERCK & CO., INC. (US) 1977-04-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120296119-A1 METHOD FOR PREPARATION OF PERFLUOROALKYL SULFENYL CHLORIDE PFAS, FLI1, PLTP CYP1A2 1196/4885CYP3A4 762/4885CYP2D6 1164/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.