SCHEMBL8559922

SCHEMBL8559922

NS(=O)(=O)c1ccccc1-c1nc(Cc2ccccc2)oc1-c1ccc(F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 8/20 0.41
FEN1 P39748 8/20 0.41
PTGES2 Q9H7Z7 2/20 0.38
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
POLB P06746 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
FAAH O00519 1/20 0.34
MAPT P10636 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL8560601 0.96 ALOX5AP (0.41) ALOX5APFEN1PTGES2PTGS1PTGS2
SCHEMBL8561143 0.92 POLB (0.37) ALOX5APFEN1PTGES2PTGS1PTGS2
SCHEMBL8556639 0.90 FAAH (0.36) ALOX5APFEN1PTGES2CA12CA1
SCHEMBL8561430 0.90 ALOX5AP (0.40) ALOX5APFEN1PTGS1PTGS2FAAH
SCHEMBL8558356 0.90 FABP1 (0.38) ALOX5APFEN1PTGES2PTGS1PTGS2
SCHEMBL8555192 0.90 POLB (0.37) ALOX5APFEN1PTGES2PTGS1PTGS2
SCHEMBL8559713 0.88 FABP1 (0.38) ALOX5APFEN1PTGS1PTGS2LTB4R
SCHEMBL8556827 0.87 GRM2 (0.42) ALOX5APFEN1CA12CA1CA2
SCHEMBL8554229 0.87 CDK9 (0.42) CA12CA1CA2CA9
SCHEMBL8559710 0.86 PTGS2 (0.42) ALOX5APFEN1PTGS1PTGS2LTB4R

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-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed