SCHEMBL7079145

SCHEMBL7079145

CC(C)(C)OC(=O)N1CC(COCCN2CCOCC2)C(c2ccc(OCCCOCc3ccccc3)cc2)C(C(=O)Cc2ccc3ccccc3c2)C1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
REN P00797 10/20 0.58
PDE4B Q07343 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
EPHX2 P34913 1/20 0.38
HRH3 Q9Y5N1 1/20 0.36
LTA4H P09960 1/20 0.36
YAP1 P46937 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 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
SCHEMBL6043948 0.92 REN (0.63) RENBCHEACHEEPHX2HRH3
SCHEMBL7079096 0.91 REN (0.57) RENBCHEACHEEPHX2LTA4H
SCHEMBL6043614 0.85 REN (0.75) RENBCHEACHEEPHX2LTA4H
SCHEMBL6043618 0.85 REN (0.75) RENBCHEACHEEPHX2LTA4H
SCHEMBL6041330 0.85 REN (0.75) RENBCHEACHEEPHX2LTA4H
SCHEMBL7084962 0.84 REN (0.71) REN
SCHEMBL7083351 0.81 REN (0.69) RENBCHEACHE
SCHEMBL6042031 0.80 REN (0.76) RENBCHEACHE
SCHEMBL6042494 0.79 REN (0.60) RENBCHEACHEEPHX2LTA4H
SCHEMBL6042520 0.79 REN (0.60) RENBCHEACHEEPHX2LTA4H

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