SCHEMBL8552633

SCHEMBL8552633

CS(=O)(=O)c1ccccc1-c1nc(C(=O)O)oc1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 10/20 0.62
RXRA P19793 6/20 0.48
RXRB P28702 5/20 0.48
RXRG P48443 3/20 0.48
ATR Q13535 2/20 0.46
PTGS2 P35354 1/20 0.44
NR4A1 P22736 2/20 0.42
NR4A3 Q92570 2/20 0.42
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL8555990 0.87 NR4A2 (0.62) NR4A2RXRARXRBRXRGPTGS2
SCHEMBL8547182 0.81 NR4A2 (0.50) NR4A2RXRARXRBRXRGATR
SCHEMBL7505639 0.80 NR4A2 (0.73) NR4A2RXRARXRBRXRGPTGS2
SCHEMBL7509020 0.80 NR4A2 (0.73) NR4A2RXRARXRBRXRGPTGS2
Methane SCHEMBL6315958 0.79 PTGS2 (0.54) NR4A2RXRARXRBRXRGATR
Methane SCHEMBL6315345 0.79 USP1 (0.47) NR4A2RXRARXRBRXRGATR
Methane SCHEMBL6743761 0.79 USP1 (0.47) NR4A2RXRARXRBRXRGATR
SCHEMBL5098755 0.78 NR4A2 (1.00) NR4A2RXRARXRBRXRGPTGS2
SCHEMBL8556511 0.77 NR4A2 (0.46) NR4A2RXRARXRBRXRGATR
SCHEMBL6309673 0.77 NR4A2 (0.59) NR4A2RXRARXRBRXRGPTGS2

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