SCHEMBL28643158

SCHEMBL28643158

CCOC(=O)CCCCc1ccc(C(=O)NCc2ccccc2OC(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.66
PPARG P37231 7/20 0.66
HPGD P15428 1/20 0.46
ROCK2 O75116 2/20 0.46
ROCK1 Q13464 1/20 0.46
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
PPARA Q07869 1/20 0.45
HDAC1 Q13547 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL28651771 0.84 EPHX2 (0.64) EPHX2PPARGHPGDCYP4F2CYP4A11
SCHEMBL28926992 0.83 EPHX2 (0.62) EPHX2PPARGCYP4F2CYP4A11
SCHEMBL16672593 0.82 CYP4F2 (0.63) EPHX2PPARGCYP4F2CYP4A11
SCHEMBL22987233 0.81 EPHX2 (0.69) EPHX2PPARGROCK2ROCK1PPARA
SCHEMBL28656783 0.80 EPHX2 (0.60) EPHX2PPARGHPGD
SCHEMBL13947519 0.80 EPHX2 (0.66) EPHX2PPARGHPGDROCK2ROCK1
SCHEMBL16672732 0.78 CYP4F2 (0.57) EPHX2PPARGCYP4F2CYP4A11
SCHEMBL28663154 0.76 MAPK14 (0.65) EPHX2PPARGHPGDPPARAHTT
SCHEMBL7398013 0.76 CYP4F2 (0.60) EPHX2PPARGCYP4F2CYP4A11
SCHEMBL28646196 0.75 PPARG (0.60) EPHX2PPARGHPGDROCK2ROCK1

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
CN-108026028-B Treatment of diabetes and metabolic syndrome with novel dual modulators of soluble epoxide hydrolase and peroxisome proliferator-activated receptors 威斯康星州医药大学股份有限公司 2021-11-09 CN disclosed