SCHEMBL14204591

SCHEMBL14204591

CCCC(=O)OC(CC1CCCCC1)C(O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.35
CTSL P07711 4/20 0.35
CTSB P07858 4/20 0.35
KLK7 P49862 3/20 0.35
CTSH P09668 2/20 0.34
CTSS P25774 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRM1 Q13255 1/20 0.34
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33

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
SCHEMBL13856086 0.89 TDP1 (0.36) CTSKCTSLCTSBKLK7CTSH
SCHEMBL14204595 0.89 CTSK (0.36) CTSKCTSLCTSBCTSHCTSS
SCHEMBL15116342 0.81 CTSK (0.37) CTSKCTSLCTSBCTSHCTSS
SCHEMBL23963426 0.80 CTSK (0.36) CTSKCTSLCTSBCTSHCTSS
SCHEMBL15116337 0.80 CTSK (0.35) CTSKCTSLCTSBCTSHCTSS
SCHEMBL20215412 0.79 CTSK (0.36) CTSKCTSLCTSBCTSHCTSS
SCHEMBL75555 0.78 CTSK (0.35) CTSKCTSLCTSBCTSHCTSS
SCHEMBL13856079 0.78 CTSK (0.36) CTSKCTSLCTSBCTSHCTSS
SCHEMBL23963424 0.78 CTSK (0.34) CTSKCTSLCTSBCTSHCTSS
SCHEMBL20215411 0.77 CTSK (0.34) CTSKCTSLCTSBCTSHCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090173-A1 POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. 2008-04-17 US disclosed
US-20080090173-A1 POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. 2008-04-17 US disclosed