SCHEMBL7076830

SCHEMBL7076830

CC(C)(C)OC(=O)ON1CCC(c2ccc3c4c(cccc24)CC3)C(OCc2ccc3ccccc3c2)C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.37
HTT P42858 1/20 0.37
REN P00797 3/20 0.36
ALDH1A1 P00352 3/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
G6PD P11413 1/20 0.35
S1PR1 P21453 1/20 0.34
CCKBR P32239 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
S1PR5 Q9H228 1/20 0.34
CHRM3 P20309 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL7080697 0.90 REN (0.38) RENCHRM3MEN1KMT2A
SCHEMBL7082058 0.83 REN (0.48) REN
SCHEMBL7083199 0.83 REN (0.46) RENMEN1KMT2A
SCHEMBL7075068 0.83 REN (0.42) REN
SCHEMBL6041537 0.82 KDM4E (0.41) KDM4EHTTRENALDH1A1MAPT
SCHEMBL7081975 0.82 REN (0.45) REN
SCHEMBL7078212 0.81 REN (0.47) REN
SCHEMBL7080440 0.81 REN (0.46) REN
SCHEMBL7075608 0.81 REN (0.48) REN
SCHEMBL7079280 0.81 REN (0.46) 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