SCHEMBL8555192

SCHEMBL8555192

NS(=O)(=O)c1ccccc1-c1oc(Cc2ccccc2)nc1-c1cc(F)ccc1F

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
ALOX5AP P20292 4/20 0.36
FEN1 P39748 4/20 0.36
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
KIF11 P52732 4/20 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
PTGES2 Q9H7Z7 2/20 0.34
FAAH O00519 1/20 0.34
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
LMNA P02545 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
SCHEMBL8561143 0.96 POLB (0.37) POLBALOX5APFEN1LTB4RLTB4R2
SCHEMBL8560601 0.92 ALOX5AP (0.41) POLBALOX5APFEN1LTB4RLTB4R2
SCHEMBL8560516 0.90 FAAH (0.36) ALOX5APFEN1CA12CA1CA2
SCHEMBL8559922 0.90 ALOX5AP (0.41) POLBALOX5APFEN1LTB4RLTB4R2
SCHEMBL8556639 0.88 FAAH (0.36) ALOX5APFEN1CA12CA1CA2
SCHEMBL8559713 0.88 FABP1 (0.38) ALOX5APFEN1LTB4RLTB4R2PTGS1
SCHEMBL8561129 0.86 PTGS2 (0.44) PTGS1PTGS2CA12CA1CA2
SCHEMBL8558356 0.86 FABP1 (0.38) ALOX5APFEN1LTB4RLTB4R2PTGS1
SCHEMBL8556529 0.85 RXRA (0.40) POLBALOX5APFEN1LTB4RLTB4R2
SCHEMBL8557992 0.85 ALOX5AP (0.41) ALOX5APFEN1PTGS1PTGS2CA12

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