SCHEMBL879732

SCHEMBL879732

Cc1ccc(OCCC(O)CO)cc1CCS(=O)(=O)N1CCC2(CC1)N=C(c1cccc(O)c1)NC2=O

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 12/20 0.43
MAPT P10636 1/20 0.32

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
SCHEMBL847239 0.90 PTH1R (0.51) PTH1R
SCHEMBL16358807 0.85 PTH1R (0.45) PTH1RMAPT
SCHEMBL850002 0.85 PTH1R (0.47) PTH1R
SCHEMBL16302341 0.81 PTH1R (0.52) PTH1RMAPT
SCHEMBL849743 0.80 PTH1R (0.45) PTH1R
SCHEMBL847496 0.80 PTH1R (0.57) PTH1R
SCHEMBL879649 0.80 PTH1R (0.47) PTH1R
SCHEMBL847529 0.79 PTH1R (0.50) PTH1R
SCHEMBL849707 0.79 PTH1R (0.48) PTH1R
SCHEMBL847567 0.78 PTH1R (0.50) PTH1R

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
EP-2433940-A1 SPIROIMIDAZOLONE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2012-03-28 EP disclosed