SCHEMBL1921057

SCHEMBL1921057

CC(=O)On1c(C)c(Cc2cccnc2S(=O)(=O)Nc2ccccc2)c2cc(F)ccc21

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.56
PTGDR Q13258 3/20 0.38
PTGIR P43119 1/20 0.37

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
SCHEMBL1466284 0.85 PTGDR2 (0.77) PTGDR2PTGDRPTGIR
SCHEMBL1466741 0.85 PTGDR2 (0.66) PTGDR2PTGDRPTGIR
SCHEMBL3722473 0.81 PTGDR2 (0.72) PTGDR2PTGDRPTGIR
SCHEMBL1921222 0.81 PTGDR2 (0.41) PTGDR2
SCHEMBL3717896 0.79 PTGDR2 (0.60) PTGDR2PTGDRPTGIR
SCHEMBL1466930 0.77 PTGDR2 (0.73) PTGDR2PTGDRPTGIR
SCHEMBL1465346 0.76 PTGDR2 (0.62) PTGDR2PTGDRPTGIR
SCHEMBL2977551 0.75 PLA2G4A (0.44) PTGDR2
SCHEMBL27799170 0.73 PTGDR2 (0.68) PTGDR2PTGDR
SCHEMBL27799169 0.73 PTGDR2 (0.76) PTGDR2PTGDRPTGIR

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-2327693-A1 Indoles and their therapeutic use Pulmagen Therapeutics (Asthma) Limited (GB) 2011-06-01 EP disclosed