SCHEMBL8558356

SCHEMBL8558356

Cc1cc(F)ccc1-c1oc(Cc2ccccc2)nc1-c1ccccc1S(N)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP1 P07148 1/20 0.38
RXRA P19793 2/20 0.37
RXRB P28702 2/20 0.37
NR4A2 P43354 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
ALOX5AP P20292 5/20 0.36
FEN1 P39748 5/20 0.36
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXRG P48443 1/20 0.35
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
KLKB1 P03952 1/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
ENPP3 O14638 1/20 0.33
TP53 P04637 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
SCHEMBL8559713 0.96 FABP1 (0.38) FABP1RXRARXRBNR4A2PTGS1
SCHEMBL8559922 0.90 ALOX5AP (0.41) PTGS1PTGS2ALOX5APFEN1MAPT
SCHEMBL8556349 0.90 RXRA (0.38) RXRARXRBNR4A2ALOX5APFEN1
SCHEMBL8555763 0.88 RXRA (0.46) RXRARXRBNR4A2NPC1HPGD
SCHEMBL8553816 0.88 MAPT (0.40) RXRARXRBNR4A2NPC1HPGD
SCHEMBL8560601 0.88 ALOX5AP (0.41) PTGS1PTGS2ALOX5APFEN1MAPT
SCHEMBL8561143 0.88 POLB (0.37) PTGS1PTGS2ALOX5APFEN1MAPT
SCHEMBL8554229 0.87 CDK9 (0.42) RXRASMN1; SMN2
SCHEMBL8561430 0.86 ALOX5AP (0.40) RXRARXRBNR4A2PTGS1PTGS2
SCHEMBL8555192 0.86 POLB (0.37) PTGS1PTGS2ALOX5APFEN1MAPT

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