SCHEMBL7082332

SCHEMBL7082332

CC(C)(C)OC(=O)ON1C2CCC1C(OCc1cc(OCc3ccccc3)c3ccccc3c1)C(c1ccc(F)cc1)C2

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.39
PTGER1 P34995 3/20 0.35
PAX8 Q06710 4/20 0.35
SLC6A3 Q01959 2/20 0.34
KDM2B Q8NHM5 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL6042720 0.85 SLC6A4 (0.42) SLC6A4PTGER1PAX8SLC6A3KDM2B
SCHEMBL7079008 0.82 REN (0.42) SLC6A4SLC6A3
SCHEMBL7081269 0.80 REN (0.47) SLC6A4SLC6A3
SCHEMBL7082510 0.78 REN (0.49)
SCHEMBL7084411 0.78 REN (0.39) SLC6A4SLC6A3
SCHEMBL7078125 0.76 REN (0.38) SLC6A4SLC6A3
SCHEMBL7081090 0.76 REN (0.38) SLC6A4SLC6A3
SCHEMBL7083931 0.75 KDM2B (0.36) PTGER1KDM2B
SCHEMBL7080911 0.73 REN (0.37) KDM2B
SCHEMBL6041889 0.72 SLC6A3 (0.38) SLC6A4SLC6A3

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