SCHEMBL7989438

SCHEMBL7989438

[CH2]OC1CCN(C(=O)OCC)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.59
L3MBTL1 Q9Y468 3/20 0.54
THRB P10828 1/20 0.54
ATM Q13315 1/20 0.54
ALDH1A1 P00352 4/20 0.51
NOS3 P29474 1/20 0.51
NOS2 P35228 1/20 0.51
CHRM1 P11229 1/20 0.50
TSHR P16473 1/20 0.50
HTT P42858 2/20 0.49
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PKM P14618 1/20 0.47
TP53 P04637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 1/20 0.46
RECQL P46063 1/20 0.46
KDM4E B2RXH2 1/20 0.45
BRD4 O60885 1/20 0.44
MEN1 O00255 1/20 0.44

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
SCHEMBL7989796 0.88 GAA (0.46) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL7992733 0.85 SMN1; SMN2 (0.56) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL3032184 0.83 GAA (0.61) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL1267093 0.81 GAA (0.62) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL7974809 0.81 EPHX1 (0.42) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL1111736 0.80 GAA (0.67) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL27460565 0.80 GAA (0.57) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL14999268 0.80 GAA (0.53) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL17471310 0.79 GAA (0.56) GAAL3MBTL1THRBATMALDH1A1
SCHEMBL3629079 0.79 GAA (0.70) GAAL3MBTL1THRBATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed