SCHEMBL6952186

SCHEMBL6952186

O=C(O)ON1CCC(c2ccc(F)cc2)C(O)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC18A3 Q16572 1/20 0.39
SLC6A4 P31645 4/20 0.38
SLC6A2 P23975 3/20 0.38
NOTUM Q6P988 1/20 0.38
HTT P42858 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL6953373 0.87 MEN1 (0.41) SLC6A3MEN1KMT2ASLC18A3SLC6A4
SCHEMBL6954026 0.87 SLC18A3 (0.51) SLC6A3MEN1KMT2ASLC18A3SLC6A4
SCHEMBL6960338 0.86 MEN1 (0.43) SLC6A3MEN1KMT2ASLC6A4SLC6A2
SCHEMBL6959529 0.86 KMT2A (0.40) SLC6A3MEN1KMT2ASLC18A3SLC6A4
SCHEMBL6955374 0.84 MEN1 (0.41) MEN1KMT2ASLC18A3HTTHRH3
SCHEMBL6947706 0.82 MEN1 (0.38) SLC6A3MEN1KMT2ASLC6A4NPC1
SCHEMBL6952629 0.79 MEN1 (0.35) MEN1KMT2ASLC18A3HTTHRH3
SCHEMBL6952881 0.79 MEN1 (0.42) MEN1KMT2ASLC18A3HTTHRH3
SCHEMBL6947646 0.79 MEN1 (0.42) MEN1KMT2ASLC18A3HTTNPC1
SCHEMBL6951299 0.79 NPC1 (0.50) HTTHRH3NPC1RAB9A

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