SCHEMBL4564735

SCHEMBL4564735

NC(=O)CCCNCCCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
TSHR P16473 3/20 0.46
THRB P10828 2/20 0.46
BLM P54132 2/20 0.46
KMT2A Q03164 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
GABRR3 A8MPY1 1/20 0.46
GABRP O00591 1/20 0.46
GABRD O14764 1/20 0.46
HDAC3 O15379 1/20 0.46
GABBR2 O75899 1/20 0.46
CYP1A2 P05177 1/20 0.46
GABRA1 P14867 1/20 0.46
GABRB1 P18505 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRR1 P24046 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRR2 P28476 1/20 0.46
SLC6A1 P30531 1/20 0.46

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
SCHEMBL112741 0.89 LMNA (0.59) LMNASLC22A6TSHRTHRBBLM
SCHEMBL26064326 0.89 MAOA (0.46) TSHRKMT2ACYP1A2HDAC6PMP22
SCHEMBL288952 0.88 MAOA (0.48) LMNASLC22A6TSHRTHRBBLM
SCHEMBL11896840 0.87 LMNA (0.56) LMNASLC22A6TSHRTHRBBLM
SCHEMBL1741769 0.87 LMNA (0.56) LMNASLC22A6TSHRTHRBBLM
SCHEMBL5085152 0.85 LMNA (0.59) LMNASLC22A6TSHRTHRBBLM
SCHEMBL31271806 0.84 MAOA (0.54) KMT2ACYP1A2HDAC6MEN1ALOX15
SCHEMBL2461935 0.84 LMNA (0.53) LMNASLC22A6TSHRTHRBBLM
SCHEMBL7389117 0.84 LMNA (0.53) LMNASLC22A6TSHRTHRBBLM
SCHEMBL2468753 0.84 LMNA (0.53) LMNASLC22A6TSHRTHRBBLM

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-1339669-A2 N-ALKYLATED GABA COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS UCB, S.A. (BE) 2003-09-03 EP claimed
WO-2002042256-A2 N-ALKYLATED GABA COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS UCB, S.A. (BE) 2002-05-30 WO claimed
EP-2049476-A1 PROCESS FOR THE PREPARATION OF LEVETIRACETAM ZaCh System S.p.A. (IT) 2009-04-22 EP disclosed
WO-2008012268-A1 PROCESS FOR THE PREPARATION OF LEVETIRACETAM ZACH SYSTEM S.P.A. (IT) 2008-01-31 WO disclosed