SCHEMBL8555570

SCHEMBL8555570

NS(=O)(=O)c1ccccc1-c1nc(COc2ccccc2C(=O)O)oc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
NR4A2 P43354 8/20 0.41
RXRA P19793 7/20 0.41
RXRB P28702 5/20 0.41
RXRG P48443 3/20 0.41
FABP3 P05413 1/20 0.41
FABP4 P15090 1/20 0.41
NR4A1 P22736 2/20 0.40
NR4A3 Q92570 2/20 0.40
VDR P11473 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 2/20 0.39
ABCC4 O15439 1/20 0.39
C5 P01031 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL8558894 0.92 RXRA (0.46) POLBRAB9ANR4A2RXRARXRB
SCHEMBL8556137 0.86 NR4A2 (0.47) RAB9ANR4A2RXRARXRBRXRG
SCHEMBL8558445 0.86 GAA (0.39) NR4A2RXRARXRBRXRGFABP3
SCHEMBL7501583 0.85 NR4A2 (0.46) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL7504292 0.85 NR4A2 (0.46) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8561919 0.84 NR4A2 (0.41) POLBRAB9ANR4A2RXRARXRB
SCHEMBL8554236 0.84 PPARD (0.42) POLBNR4A2RXRARXRBRXRG
SCHEMBL8555127 0.82 NPC1 (0.41) RAB9ANR4A2RXRARXRBRXRG
SCHEMBL8558559 0.82 NR4A2 (0.45) RAB9ANR4A2FABP4VDRPPARD
SCHEMBL8557612 0.80 RXRA (0.43) NR4A2RXRARXRBRXRGNR4A1

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