SCHEMBL8559396

SCHEMBL8559396

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.48
RXRB P28702 5/20 0.48
RXRG P48443 3/20 0.48
PTGS1 P23219 1/20 0.47
EPHX2 P34913 1/20 0.47
PTGS2 P35354 1/20 0.47
PTGES2 Q9H7Z7 3/20 0.43
NR4A2 P43354 4/20 0.42
MAOB P27338 2/20 0.41
F10 P00742 1/20 0.40
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NR4A1 P22736 1/20 0.37
NR4A3 Q92570 1/20 0.37
MAOA P21397 1/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37

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
SCHEMBL8560006 0.92 RXRA (0.48) RXRARXRBRXRGPTGS1EPHX2
SCHEMBL8558066 0.91 NR4A2 (0.40) RXRARXRBRXRGPTGS1EPHX2
SCHEMBL8559262 0.91 NR4A2 (0.40) RXRARXRBRXRGPTGS1EPHX2
SCHEMBL8561125 0.88 PTGS2 (0.47) RXRARXRBRXRGPTGS1EPHX2
SCHEMBL8559470 0.88 RXRA (0.41) RXRARXRBRXRGPTGS1EPHX2
SCHEMBL8555226 0.88 RXRA (0.46) RXRARXRBRXRGPTGS1PTGS2
SCHEMBL8555143 0.88 RXRA (0.49) RXRARXRBRXRGNR4A2F10
SCHEMBL8557928 0.87 RXRA (0.47) RXRARXRBRXRGNR4A2MAOB
SCHEMBL8556768 0.87 NR4A2 (0.45) RXRARXRBRXRGPTGS1EPHX2
SCHEMBL8558990 0.86 NR4A2 (0.39) RXRARXRBRXRGPTGS1PTGS2

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