SCHEMBL7079460

SCHEMBL7079460

CC(C)(C)OC(=O)ON1CCC(c2ccc(OCCOc3ccccc3)cc2)C(OC(=O)c2ccc3ccccc3c2)C1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
REN P00797 6/20 0.43
HRH3 Q9Y5N1 2/20 0.38
KDM2B Q8NHM5 3/20 0.38
BCHE P06276 1/20 0.37
DRD3 P35462 1/20 0.37
PDE4B Q07343 1/20 0.36
CHRM3 P20309 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL7080908 0.95 REN (0.41) RENHRH3KDM2BBCHEDRD3
SCHEMBL7081557 0.88 HTR7 (0.38) HRH3DRD3NPC1RAB9A
SCHEMBL7080924 0.85 REN (0.54) REN
SCHEMBL7078656 0.83 REN (0.54) REN
SCHEMBL7075237 0.83 REN (0.56) REN
SCHEMBL7077364 0.83 REN (0.64) REN
SCHEMBL6042842 0.82 REN (0.45) RENHRH3KDM2BBCHENPC1
SCHEMBL7074937 0.81 MEN1 (0.41) PDE4BNPC1
SCHEMBL7077960 0.81 YAP1 (0.41) REN
SCHEMBL7076058 0.81 REN (0.57) REN

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