SCHEMBL7074869

SCHEMBL7074869

COc1cc(COC2CN(OC(=O)OC(C)(C)C)CCC2c2ccc(OC/C=C/c3ccccc3)cc2)c(OC)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.44
SSTR5 P35346 3/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 1/20 0.34
MAPK1 P28482 1/20 0.33
PDE4B Q07343 1/20 0.32
ACKR3 P25106 1/20 0.32
MCHR1 Q99705 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL7076705 0.93 REN (0.46) RENSSTR5ALDH1A1SMN1; SMN2MAPK1
SCHEMBL7079331 0.90 REN (0.46) RENSSTR5PDE4B
SCHEMBL7079908 0.89 REN (0.52) RENSSTR5PDE4B
SCHEMBL7076766 0.89 REN (0.54) RENSSTR5PDE4B
SCHEMBL7082883 0.88 REN (0.46) RENSSTR5ALDH1A1PDE4B
SCHEMBL6042526 0.87 REN (0.47) RENSSTR5ALDH1A1SMN1; SMN2KMT2A
SCHEMBL8183012 0.87 REN (0.47) RENSSTR5ALDH1A1SMN1; SMN2KMT2A
SCHEMBL7079907 0.86 REN (0.43) RENSSTR5PDE4B
SCHEMBL7084760 0.86 REN (0.54) RENSSTR5ALDH1A1PDE4B
SCHEMBL7079511 0.86 REN (0.54) RENPDE4B

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 3 patents. 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
EP-0863875-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1998-09-16 EP disclosed
WO-1997009311-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1997-03-13 WO disclosed