SCHEMBL6955166

SCHEMBL6955166

O=C(O)ON1CCC(c2ccccn2)C(O)C1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.36
SLC6A9 P48067 1/20 0.36
HSD11B1 P28845 2/20 0.36
KDM5A P29375 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
DPP4 P27487 1/20 0.35
SPR P35270 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CASP1 P29466 1/20 0.34
CYP2D6 P10635 1/20 0.34
SLC18A3 Q16572 1/20 0.34
RIPK1 Q13546 2/20 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
SCHEMBL6956345 0.84 GPR119 (0.42) USP30DPP4ALDH1A1CASP1RIPK1
SCHEMBL6954026 0.81 SLC18A3 (0.51) SLC18A3
SCHEMBL6042688 0.80 USP30 (0.43) USP30SLC6A9HSD11B1KDM5ASIGMAR1
SCHEMBL6952881 0.73 MEN1 (0.42) L3MBTL1ALDH1A1SLC18A3
SCHEMBL6947646 0.73 MEN1 (0.42) L3MBTL1ALDH1A1SLC18A3
SCHEMBL6951299 0.73 NPC1 (0.50) L3MBTL1ALDH1A1
SCHEMBL6953373 0.73 MEN1 (0.41) SLC18A3
SCHEMBL6954969 0.72 CHRNB2 (0.43)
SCHEMBL6959529 0.72 KMT2A (0.40) CYP3A4CYP2C9L3MBTL1ALDH1A1CYP2D6
SCHEMBL6952186 0.72 SLC6A3 (0.40) SIGMAR1SLC18A3

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 1 patent. 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