SCHEMBL9943602

SCHEMBL9943602

CC(=O)OS(=O)CCC(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.31
CES2 O00748 2/20 0.31
CES1 P23141 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL2134268 0.73 CA1 (0.33)
SCHEMBL28752442 0.70 ALDH1A1 (0.43) FAAHCES2CES1
SCHEMBL27673590 0.67
SCHEMBL14878814 0.64
SCHEMBL124955 0.64 ALDH1A1 (0.46) GAA
SCHEMBL3630839 0.61 GAA (0.32) GAA
SCHEMBL9963673 0.61 ALDH1A1 (0.54) GAA
SCHEMBL16340595 0.61
SCHEMBL9969950 0.61 CES2 (0.47) CES2
SCHEMBL4003136 0.60 ALDH1A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2664613-A1 Process for producing amide compounds Sumitomo Chemical Company, Limited (JP) 2013-11-20 EP disclosed
EP-2662355-A1 Process for producing a (fluoroalkylthio) acetonitrile Sumitomo Chemical Company, Limited (JP) 2013-11-13 EP disclosed
EP-2465846-A1 PROCESS FOR PREPARATION OF (FLUOROALKYLTHIO)ACETIC ACID ESTERS Sumitomo Chemical Company, Limited (JP) 2012-06-20 EP disclosed