SCHEMBL7604063

SCHEMBL7604063

NC(=O)COCCN1CCN(C(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.40
LTA4H P09960 1/20 0.39
KCNA5 P22460 5/20 0.37
HRH1 P35367 3/20 0.36
DRD3 P35462 2/20 0.36
SLC6A2 P23975 1/20 0.36
HRH2 P25021 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TEK Q02763 1/20 0.36
KCNH2 Q12809 1/20 0.36
USP2 O75604 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TEAD3 Q99594 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
HSD11B1 P28845 1/20 0.34
MEN1 O00255 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
SCHEMBL4710700 0.82 L3MBTL1 (0.53) TACR1L3MBTL1MEN1KMT2A
SCHEMBL7609141 0.81 HRH2 (0.49) HRH1HRH2
SCHEMBL4709553 0.80 L3MBTL1 (0.57) L3MBTL1MEN1KMT2A
SCHEMBL7611072 0.80 HRH1 (0.41) KCNA5HRH1DRD3SLC6A2HRH2
SCHEMBL7605519 0.80 TLR8 (0.46) USP2
SCHEMBL21855434 0.79 SIGMAR1 (0.39) LTA4HKCNA5TDP1TEAD3SIGMAR1
SCHEMBL3553321 0.79 NAMPT (0.44) KCNA5HRH1DRD3HRH2HTR2A
SCHEMBL22577684 0.78 HRH1 (0.44) HRH1HRH2
SCHEMBL22266212 0.77 L3MBTL1 (0.53) L3MBTL1MEN1KMT2A
SCHEMBL7603566 0.77 MEN1 (0.44) HRH1HRH2TDP1SIGMAR1MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927173-B1 SUBSTITUTED [2-(1-PIPERAZINYL)ETHOXY]METHYL UCB SA (BE) 2002-06-12 EP claimed
EP-0927173-B1 SUBSTITUTED [2-(1-PIPERAZINYL)ETHOXY]METHYL UCB SA (BE) 2002-06-12 EP disclosed
EP-0927173-A1 SUBSTITUTED [2-(1-PIPERAZINYL)ETHOXY]METHYL UCB, S.A. (BE) 1999-07-07 EP disclosed
WO-1997037982-A1 NOVEL SUBSTITUTED [2-(1-PIPERAZINYL)ETHOXY]METHYL UCB S.A. (BE) 1997-10-16 WO disclosed