SCHEMBL8557992

SCHEMBL8557992

NS(=O)(=O)c1ccccc1-c1oc(Cc2ccccc2)nc1-c1ccc(F)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 6/20 0.41
FEN1 P39748 6/20 0.41
PTGS1 P23219 4/20 0.40
PTGS2 P35354 4/20 0.40
F10 P00742 2/20 0.40
LDHA P00338 1/20 0.36
LDHB P07195 1/20 0.36
SCN9A Q15858 1/20 0.35
MAOB P27338 1/20 0.35
NR4A2 P43354 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
CA14 Q9ULX7 1/20 0.34
GPR68 Q15743 1/20 0.34
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34

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
SCHEMBL8554948 0.92 PTGS2 (0.42) ALOX5APFEN1PTGS1PTGS2F10
SCHEMBL8557215 0.91 PTGS2 (0.42) ALOX5APFEN1PTGS1PTGS2F10
SCHEMBL8556992 0.91 PTGS1 (0.40) ALOX5APFEN1PTGS1PTGS2F10
SCHEMBL8561414 0.88 PTGS2 (0.47) ALOX5APFEN1PTGS1PTGS2SCN9A
SCHEMBL8561129 0.88 PTGS2 (0.44) PTGS1PTGS2SCN9ANR4A2CA12
SCHEMBL8556529 0.88 RXRA (0.40) ALOX5APFEN1PTGS1PTGS2F10
SCHEMBL8555605 0.87 RXRA (0.44) ALOX5APFEN1PTGS1PTGS2SCN9A
SCHEMBL8556768 0.87 NR4A2 (0.45) PTGS1PTGS2NR4A2RXRARXRB
SCHEMBL8555226 0.86 RXRA (0.46) PTGS1PTGS2NR4A2RXRARXRB
SCHEMBL8560516 0.86 FAAH (0.36) ALOX5APFEN1SCN9ANR4A2CA12

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