SCHEMBL8557933

SCHEMBL8557933

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 16/20 0.47
RXRA P19793 8/20 0.47
RXRB P28702 6/20 0.47
RXRG P48443 4/20 0.47
NR4A1 P22736 3/20 0.47
NR4A3 Q92570 3/20 0.47
KDM4E B2RXH2 1/20 0.45
ABCC4 O15439 1/20 0.45
C5 P01031 1/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
CHRM1 P11229 1/20 0.45
DRD2 P14416 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
TBXA2R P21731 1/20 0.45
PTGS1 P23219 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL8547023 0.90 RXRA (0.51) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8547540 0.90 NR4A2 (0.49) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8554884 0.88 NR4A2 (0.65) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8560633 0.87 RXRA (0.47) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8547182 0.87 NR4A2 (0.50) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8557473 0.86 NR4A2 (0.44) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8556748 0.85 RXRA (0.67) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8555236 0.85 NR4A2 (0.48) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8554938 0.85 RXRA (0.51) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8559309 0.83 RXRA (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996036617-A1 SUBSTITUTED OXAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-11-21 WO claimed
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed