SCHEMBL7078288

SCHEMBL7078288

COc1cc(COC2CN(OC(=O)OC(C)(C)C)CCC2c2cnc(S(C)(=O)=O)nc2)c(OC)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.43
SSTR5 P35346 5/20 0.37
GPR119 Q8TDV5 8/20 0.32
CFTR P13569 3/20 0.31
PDE4B Q07343 1/20 0.30

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
SCHEMBL7077413 0.91 REN (0.43) RENSSTR5GPR119
SCHEMBL7080957 0.89 REN (0.44) RENSSTR5CFTR
SCHEMBL7082580 0.86 REN (0.44) RENSSTR5CFTR
SCHEMBL7079907 0.86 REN (0.43) RENSSTR5CFTRPDE4B
SCHEMBL6042376 0.85 REN (0.47) RENSSTR5PDE4B
SCHEMBL7079908 0.83 REN (0.52) RENSSTR5PDE4B
SCHEMBL7076766 0.83 REN (0.54) RENSSTR5PDE4B
SCHEMBL7084760 0.82 REN (0.54) RENSSTR5PDE4B
SCHEMBL7082883 0.82 REN (0.46) RENSSTR5PDE4B
SCHEMBL7079331 0.82 REN (0.46) RENSSTR5PDE4B

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-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed