SCHEMBL20215411

SCHEMBL20215411

CCC(C)(I)C(=O)OC(CC1CCCC1)C(O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.34
CTSS P25774 1/20 0.34
CTSL P07711 2/20 0.32
CTSB P07858 2/20 0.32
CTSH P09668 2/20 0.32
PDK1 Q15118 1/20 0.30
PDK2 Q15119 1/20 0.30
PDK3 Q15120 1/20 0.30
PDK4 Q16654 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
SCHEMBL20215412 0.99 CTSK (0.36) CTSKCTSSCTSLCTSBCTSH
SCHEMBL15116337 0.86 CTSK (0.35) CTSKCTSSCTSLCTSBCTSH
SCHEMBL15116342 0.85 CTSK (0.37) CTSKCTSSCTSLCTSBCTSH
SCHEMBL18473870 0.80 CYP2D6 (0.31)
SCHEMBL14204595 0.80 CTSK (0.36) CTSKCTSSCTSLCTSBCTSH
SCHEMBL20215381 0.79
SCHEMBL18476621 0.78 PDK1 (0.34) PDK1PDK2PDK3PDK4
SCHEMBL20215414 0.78 EPHX2 (0.32)
SCHEMBL20215392 0.77 PDK1 (0.36) PDK1PDK2PDK3PDK4
SCHEMBL15113930 0.77 CTSK (0.34) CTSKCTSSCTSLCTSBCTSH

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-10234757-B2 Polymer, making method, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-03-19 US disclosed
US-9989847-B2 Onium salt compound, resist composition, and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-06-05 US disclosed