SCHEMBL13713640

SCHEMBL13713640

CCC(C)(C(F)(F)C(C)S(=O)(=O)O)S(=O)(=O)N1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.35
PDK1 Q15118 2/20 0.32
PDK2 Q15119 2/20 0.32
PDK3 Q15120 2/20 0.32
PDK4 Q16654 2/20 0.32
ABCC9 O60706 2/20 0.32
ABCC8 Q09428 2/20 0.32
KCNJ11 Q14654 2/20 0.32
KCNJ8 Q15842 2/20 0.32
GAA P10253 2/20 0.32
LMNA P02545 1/20 0.32
CNR1 P21554 4/20 0.31
CNR2 P34972 4/20 0.31
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL13713608 0.84 HTT (0.32) HTTCNR1CNR2
SCHEMBL13451001 0.84 HTT (0.32) HTTCNR1CNR2
SCHEMBL13713644 0.84 HTT (0.32) HTTCNR1CNR2
SCHEMBL12832587 0.83 LMNA (0.34) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL13713610 0.82 HTT (0.30) HTT
SCHEMBL13713620 0.81 HTT (0.32) HTTCNR1CNR2
SCHEMBL16317483 0.76 LMNA (0.38) HTTPDK1PDK2PDK3PDK4
SCHEMBL18594459 0.76 HTT (0.38) HTTGAALMNACNR1CNR2
SCHEMBL13713604 0.75 HTT (0.33) HTTPDK1PDK2PDK3PDK4
SCHEMBL16687718 0.74 LMNA (0.35) HTTABCC9ABCC8KCNJ11KCNJ8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592126-B2 Positive resist composition and pattern forming method using the resist composition FUJIFILM CORPORATION (JP) 2009-09-22 US disclosed