SCHEMBL8558445

SCHEMBL8558445

NS(=O)(=O)c1ccccc1-c1nc(COc2ccccc2F)oc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
RXRA P19793 4/20 0.38
NR4A2 P43354 4/20 0.38
RXRB P28702 3/20 0.38
RXRG P48443 2/20 0.38
HPGD P15428 6/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RECQL P46063 1/20 0.38
TSHR P16473 5/20 0.38
MAPT P10636 4/20 0.38
MAPK1 P28482 4/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 2/20 0.38
NR4A1 P22736 2/20 0.37
NR4A3 Q92570 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX5AP P20292 2/20 0.36

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
SCHEMBL8555996 0.92 RXRA (0.43) GAARXRANR4A2RXRBRXRG
SCHEMBL8555127 0.88 NPC1 (0.41) RXRANR4A2RXRBRXRGALDH1A1
SCHEMBL8556137 0.88 NR4A2 (0.47) RXRANR4A2RXRBRXRGHPGD
SCHEMBL8561919 0.86 NR4A2 (0.41) RXRANR4A2RXRBRXRGHPGD
SCHEMBL8555570 0.86 POLB (0.43) RXRANR4A2RXRBRXRGHPGD
SCHEMBL7502967 0.84 PTGS2 (0.51) RXRANR4A2RXRBRXRGHPGD
SCHEMBL7500441 0.84 PTGS2 (0.51) RXRANR4A2RXRBRXRGHPGD
SCHEMBL8559035 0.83 GRM5 (0.41) RXRANR4A2RXRBRXRGALOX5AP
SCHEMBL8557612 0.81 RXRA (0.43) RXRANR4A2RXRBRXRGHPGD
SCHEMBL8554236 0.80 PPARD (0.42) RXRANR4A2RXRBRXRGHPGD

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