SCHEMBL8343399

SCHEMBL8343399

CN1CC[C@@H](Oc2cc(N[S+]([O-])c3cc(C(=O)N4CCOCC4)c(Cl)s3)ccc2C(F)(F)F)C1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 12/20 0.52
LRRK2 Q5S007 3/20 0.38
ABL1 P00519 2/20 0.36
KIT P10721 2/20 0.36
GAA P10253 1/20 0.35
EPHX2 P34913 2/20 0.35

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
SCHEMBL8337207 0.85 UTS2R (0.53) UTS2R
SCHEMBL8339344 0.79 UTS2R (0.53) UTS2R
SCHEMBL8340930 0.78 UTS2R (0.53) UTS2R
SCHEMBL8338638 0.78 UTS2R (0.48) UTS2R
SCHEMBL8340407 0.77 UTS2R (0.52) UTS2R
SCHEMBL8338944 0.77 UTS2R (0.51) UTS2R
SCHEMBL8339680 0.74 UTS2R (0.60) UTS2R
SCHEMBL8342538 0.74 UTS2R (0.54) UTS2R
SCHEMBL8342573 0.74 UTS2R (0.49) UTS2R
SCHEMBL8339648 0.72 UTS2R (0.47) 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-2004043366-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed