SCHEMBL2059538

SCHEMBL2059538

FC(F)(F)C(Cc1ccccc1)SC(Cc1ccccc1)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
CPA1 P15085 1/20 0.42
TAAR1 Q96RJ0 4/20 0.41
SLC6A2 P23975 2/20 0.41
SIGMAR1 Q99720 2/20 0.41
MAOA P21397 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CYP2A6 P11509 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
CYP1A2 P05177 1/20 0.40
SLC18A2 Q05940 1/20 0.39
ANPEP P15144 1/20 0.39
CYP2D6 P10635 1/20 0.39
ACE P12821 1/20 0.38
CES1 P23141 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
SCHEMBL3238111 0.76 EPHX1 (0.48) EPHX1CPA1TAAR1SLC6A2SIGMAR1
Hydrochloric Acid SCHEMBL5385721 0.76 EPHX1 (0.54) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL16034061 0.74 EPHX1 (0.46) EPHX1CPA1TAAR1SLC6A2SIGMAR1
SCHEMBL5609280 0.73 CPA1 (0.46) EPHX1CPA1TAAR1SLC6A2SIGMAR1
SCHEMBL7256073 0.73 EPHX1 (0.44) EPHX1CPA1TAAR1SLC6A2SIGMAR1
SCHEMBL838906 0.73 MEN1 (0.46) EPHX1CPA1TAAR1SLC6A2SIGMAR1
SCHEMBL10693279 0.73 EPHX1 (0.44) EPHX1CPA1TAAR1SLC6A2SIGMAR1
SCHEMBL5609146 0.73 ACE (0.53) EPHX1CPA1TAAR1SLC6A2SIGMAR1
SCHEMBL6380241 0.73 EPHX1 (0.56) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL638408 0.73 EPHX1 (0.56) EPHX1TAAR1SLC6A2SIGMAR1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968743-B2 Thiocarbonylthio compound and free radical polymerization employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2011-06-28 US disclosed
US-20100048844-A1 THIOCARBONYLTHIO COMPOUND AND FREE RADICAL POLYMERIZATION EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2010-02-25 US disclosed
US-7632959-B2 free-radical polymerization process of vinyl monomer in the presence of the above thiocarbonylthio compound; molecular weight control and narrow polydispersity INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-12-15 US disclosed
US-20060270867-A1 Thiocarbonylthio compound and free radical polymerization employing the same MEDIATEK INCORPORATION 2006-11-30 US disclosed
US-6191297-B1 HYDROSILATION OF FUNCTIONALLIZED ALLYL COMPOUNDS, E.G. ALLYL CHLORIDE, BY HYDROGEN SILANES, E.G. DICHLOROMETHYLSILANE, USING A CATALYST OF A COMPLEX OF PLATINUM AND ONE OR MORE SULFUR-CONTAINING LIGANDS; EFFICIENCY DEGUSSA-HULS AG (DE) 2001-02-20 US disclosed
EP-0645355-B1 Method for the preparation of trifluoroethyl sulphur compounds from thiolates and 1-chloro-2,2,2-trifluoroethane SOLVAY (BE) 2000-03-22 EP disclosed
CN-1241570-A New process for preparation of organosilanes functionalised in the 3-position DEGUSSA (DE) 2000-01-19 CN 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-20060270867-A1 Thiocarbonylthio compound and free radical polymerization employing the same FFAR3, CBR3, CTH EPHX1 4298/4885CPA1 2549/4885TAAR1 849/4885

“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.