SCHEMBL1848612

SCHEMBL1848612

CCCCCCCC(CO)NCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.50
EPHX2 P34913 2/20 0.48
CSNK1E P49674 1/20 0.47
CNR2 P34972 1/20 0.46
CERT1 Q9Y5P4 3/20 0.42
FAAH O00519 1/20 0.42
TLR8 Q9NR97 2/20 0.41
TLR7 Q9NYK1 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
CDK1 P06493 1/20 0.41
CDK5 Q00535 1/20 0.41

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
SCHEMBL1847140 1.00 TLR2 (0.50) TLR2EPHX2CSNK1ECNR2CERT1
SCHEMBL1846613 1.00 TLR2 (0.50) TLR2EPHX2CSNK1ECNR2CERT1
SCHEMBL1846848 0.98 TLR2 (0.48) TLR2EPHX2CSNK1ECNR2TLR8
SCHEMBL1848754 0.94 TLR8 (0.46) TLR2EPHX2CNR2TLR8TLR7
SCHEMBL23634016 0.90 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2FAAH
SCHEMBL19087037 0.90 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2FAAH
SCHEMBL1091520 0.90 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2FAAH
SCHEMBL11349595 0.90 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2FAAH
SCHEMBL22363311 0.90 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2FAAH
SCHEMBL7065867 0.90 TLR2 (0.51) TLR2EPHX2CSNK1ECNR2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102186812-A Methods for preparing fluoroalkyl arylsulfinyl compounds and fluorinated compounds thereto UBE INDUSTRIES 2011-09-14 CN disclosed
US-20110190511-A1 Methods For Preparing Fluoroalkyl Arylsulfinyl Compounds And Fluorinated Compounds Thereto IM&T RESEARCH, INC. (US) 2011-08-04 US disclosed
EP-2323974-A1 METHODS FOR PREPARING FLUOROALKYL ARYLSULFINYL COMPOUNDS AND FLUORINATED COMPOUNDS THERETO Ube Industries, Ltd. (JP) 2011-05-25 EP disclosed
US-20100152463-A1 Methods for Preparing Fluoroalkyl Arylsulfinyl Compounds and Fluorinated Compounds Thereto IM&T RESEARCH, INC. (US) 2010-06-17 US disclosed
WO-2010022001-A1 METHODS FOR PREPARING FLUOROALKYL ARYLSULFINYL COMPOUNDS AND FLUORINATED COMPOUNDS THERETO IM&T RESEARCH, INC. (US) 2010-02-25 WO 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 (2 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-20100152463-A1 Methods for Preparing Fluoroalkyl Arylsulfinyl Compounds and Fluorinated Compounds Thereto PFAS, AGPS, FDPS TLR2 4825/4885EPHX2 333/4885CSNK1E 4256/4885
US-20110190511-A1 Methods For Preparing Fluoroalkyl Arylsulfinyl Compounds And Fluorinated Compounds Thereto PFAS, AGPS, FDPS TLR2 4782/4885EPHX2 637/4885CSNK1E 4450/4885

“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.