SCHEMBL6959615

SCHEMBL6959615

CC(C)(C)OC(=O)ON1CCC(c2ccc(F)cc2)C(OCc2ccc3c(c2)OCCO3)C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
LMNA P02545 6/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
TERT O14746 2/20 0.36
ALDH1A1 P00352 2/20 0.36
THRB P10828 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.35
CTNNB1 P35222 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL7078323 0.84 REN (0.45)
SCHEMBL7076957 0.84 MC4R (0.36)
SCHEMBL6947606 0.84 REN (0.45)
SCHEMBL6957468 0.84 MC4R (0.37)
SCHEMBL6960686 0.83 KCNH2 (0.35) MAPTHTTALDH1A1
SCHEMBL6958090 0.83 HCRTR1 (0.35) KDM4ELMNASMN1; SMN2HTTNPSR1
SCHEMBL6952166 0.83 REN (0.41) KMT2AMEN1L3MBTL1
SCHEMBL6949602 0.82 GPR119 (0.39) KMT2ASMN1; SMN2MEN1
SCHEMBL6955914 0.82 GPR119 (0.43)
SCHEMBL7077967 0.82 REN (0.41)

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