SCHEMBL8619059

SCHEMBL8619059

NS(=O)(=O)c1ccc(-c2nc(CC(=O)O)oc2-c2ccc(F)c(F)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 5/20 0.53
NR4A1 P22736 2/20 0.53
NR4A3 Q92570 2/20 0.53
PTGS2 P35354 7/20 0.47
PTGS1 P23219 6/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.44
RXRA P19793 8/20 0.42
RXRB P28702 8/20 0.42
RXRG P48443 8/20 0.42
LDHA P00338 1/20 0.41
LDHB P07195 1/20 0.41
SOS1 Q07889 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ABCC4 O15439 1/20 0.40
C5 P01031 1/20 0.40
LMNA P02545 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD2 P14416 1/20 0.40

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
SCHEMBL5733857 0.90 NR4A2 (0.50) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL5732493 0.88 PTGS2 (0.51) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL7503465 0.87 PTGS2 (0.62) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL5732336 0.85 NR4A2 (0.60) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL5733069 0.85 NR4A2 (0.60) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL5763378 0.85 NR4A2 (0.75) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL5734304 0.85 NR4A2 (0.75) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL5731953 0.84 RXRA (0.59) NR4A2NR4A1NR4A3PTGS2PTGS1
SCHEMBL7501079 0.83 CA1 (0.47) PTGS2PTGS1RXRARXRBRXRG
SCHEMBL7508644 0.79 CA1 (0.47) PTGS2PTGS1LDHALDHBSOS1

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
EP-0825989-A1 SUBSTITUTED OXAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1998-03-04 EP disclosed