SCHEMBL27870233

SCHEMBL27870233

CC(=O)N1CCN(OCCCOc2cccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)c2)CC1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 20/20 0.79

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
SCHEMBL27853348 0.77 EPHX2 (1.00) EPHX2
SCHEMBL12932046 0.77 EPHX2 (1.00) EPHX2
SCHEMBL4257580 0.77 EPHX2 (1.00) EPHX2
SCHEMBL2321979 0.76 EPHX2 (1.00) EPHX2
SCHEMBL12932205 0.75 EPHX2 (1.00) EPHX2
SCHEMBL27853373 0.74 EPHX2 (1.00) EPHX2
SCHEMBL27853337 0.74 EPHX2 (1.00) EPHX2
SCHEMBL4255244 0.74 EPHX2 (0.73) EPHX2
SCHEMBL27870148 0.73 EPHX2 (1.00) EPHX2
SCHEMBL12932208 0.72 EPHX2 (0.77) EPHX2

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-102464631-A Piperazine substituted 1,3-disubstitued urea compounds and piperazine substituted amide compounds, preparation method, and use thereof SHANGHAI INST MATERIA MEDICA 2012-05-23 CN disclosed