SCHEMBL7078232

SCHEMBL7078232

COc1ccc(C(=O)NCc2ccc(C3CCN(OC(=O)OC(C)(C)C)CC3OCc3ccc4ccccc4c3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.46
REN P00797 4/20 0.46
MAPT P10636 3/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 3/20 0.42
GAA P10253 1/20 0.42
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
MEN1 O00255 1/20 0.42
EPHX2 P34913 1/20 0.42
KMT2A Q03164 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DRD4 P21917 1/20 0.40
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL7080647 0.95 REN (0.48) MAOARENNR1H4DRD2DRD3
SCHEMBL7074891 0.89 REN (0.48) REN
SCHEMBL7076301 0.88 REN (0.49) REN
SCHEMBL7084239 0.87 REN (0.48) REN
SCHEMBL7080501 0.87 KDM1A (0.44) MAOARENLMNASMN1; SMN2NPC1
SCHEMBL7076058 0.86 REN (0.57) RENDRD4
SCHEMBL7079272 0.86 REN (0.64) RENSMN1; SMN2NPC1RAB9A
SCHEMBL7085159 0.86 REN (0.51) REN
SCHEMBL7077640 0.86 REN (0.43) RENNPC1EPHX2
SCHEMBL7081654 0.85 REN (0.44) RENKMT2AL3MBTL1ALDH1A1

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