SCHEMBL6824855

SCHEMBL6824855

CN1CCC(Oc2cc(NS(=O)(=O)c3cnc(Oc4ccc(C(F)(F)F)cc4)c(Br)c3)ccc2C(F)(F)F)C1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 17/20 0.59
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 1/20 0.39
XBP1 P17861 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CACNA1H O95180 1/20 0.36
CACNA1B Q00975 1/20 0.36

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
SCHEMBL6824846 1.00 UTS2R (0.59) UTS2RLMNAMAPTHTTPOLB
SCHEMBL6825135 0.94 UTS2R (0.63) UTS2R
SCHEMBL6825126 0.94 UTS2R (0.63) UTS2R
SCHEMBL6818819 0.91 UTS2R (0.59) UTS2R
SCHEMBL6822524 0.90 UTS2R (0.65) UTS2R
SCHEMBL6822582 0.90 UTS2R (0.56) UTS2RLMNAMAPTHTTPOLB
SCHEMBL6822522 0.90 UTS2R (0.65) UTS2R
SCHEMBL6822584 0.90 UTS2R (0.56) UTS2RLMNAMAPTHTTPOLB
SCHEMBL6825087 0.90 UTS2R (0.58) UTS2R
SCHEMBL6818562 0.90 UTS2R (0.58) UTS2R

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
WO-2004043948-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO claimed