SCHEMBL7079008

SCHEMBL7079008

CC(C)(C)OC(=O)ON1C2CCC1C(OCc1ccc3ccccc3c1)C(c1ccc(COCc3ccccc3)cc1)C2

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 11/20 0.42
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38

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
SCHEMBL7081269 0.97 REN (0.47) RENSLC6A4SLC6A3
SCHEMBL7082510 0.92 REN (0.49) REN
SCHEMBL7078125 0.92 REN (0.38) RENSLC6A4SLC6A3
SCHEMBL7084411 0.91 REN (0.39) RENSLC6A4SLC6A3
SCHEMBL7081090 0.89 REN (0.38) RENSLC6A4SLC6A3
SCHEMBL7566649 0.88 REN (0.43) RENSLC6A4SLC6A3
SCHEMBL6043673 0.83 REN (0.47) RENSLC6A4SLC6A3
SCHEMBL7082332 0.82 SLC6A4 (0.39) SLC6A4SLC6A3
SCHEMBL6043213 0.79 REN (0.52) REN
SCHEMBL7566629 0.79 SLC6A4 (0.40) RENSLC6A4SLC6A3

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