SCHEMBL7423742

SCHEMBL7423742

CC(C)(C)OC(=O)NC1Cc2ccccc2C1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.48
KDM1A O60341 2/20 0.45
MAOB P27338 2/20 0.45
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DRD2 P14416 2/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
ATM Q13315 1/20 0.41
IDO1 P14902 1/20 0.39
BTK Q06187 1/20 0.39
NAMPT P43490 1/20 0.38
KCNA3 P22001 1/20 0.38
MAOA P21397 1/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
FABP5 Q01469 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL4654164 1.00 EPHX2 (0.48) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL14016078 1.00 EPHX2 (0.48) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL4758658 0.91 EPHX2 (0.44) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL14259285 0.88 EPHX2 (0.47) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL4914877 0.88 EPHX2 (0.47) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL5034414 0.88 EPHX2 (0.47) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL14015839 0.88 EPHX2 (0.47) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL7328550 0.85 EPHX2 (0.49) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL8635461 0.85 EPHX2 (0.49) EPHX2KDM1AMAOBKMT2AL3MBTL1
SCHEMBL3328981 0.83 PYGL (0.49) EPHX2KDM1AMAOBKMT2AL3MBTL1

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
WO-1996036596-A1 3,4-DISUBSTITUTED-PHENYLSULPHONAMIDES AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-21 WO disclosed