SCHEMBL28766052

SCHEMBL28766052

CC(C)(C)OC(=O)CN1CCCN(C2CCN(C(=O)O)CC2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
RAMP1 O60894 3/20 0.39
CALCRL Q16602 3/20 0.39
PLA2G10 O15496 2/20 0.37
PLA2G5 P39877 2/20 0.37
USP30 Q70CQ3 2/20 0.37
PER2 O15055 4/20 0.36
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
SCN9A Q15858 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
FPR2 P25090 1/20 0.33
HPGD P15428 1/20 0.33
GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL27689173 0.84 L3MBTL1 (0.38) TP53PER2KDM4E
SCHEMBL5499122 0.83 L3MBTL1 (0.37) TP53PER2KDM4E
SCHEMBL2853067 0.83 SMN1; SMN2 (0.48) TP53PLA2G10PLA2G5USP30GPR119
SCHEMBL27689294 0.82 PER2 (0.38) TP53PER2
SCHEMBL27689180 0.77 FKBP1A (0.37) CALCRLPER2
SCHEMBL27670252 0.76 PER2 (0.38) PER2KDM4E
SCHEMBL27689238 0.75 ALDH1A1 (0.45) TP53KDM4EMAPTTHRB
SCHEMBL8916277 0.74 PLA2G10 (0.47) PLA2G10PLA2G5PER2KDM4ESCN9A
SCHEMBL6282329 0.73 PLA2G10 (0.47) PLA2G10PLA2G5KDM4EMAPTTHRB
SCHEMBL27162983 0.71 TP53 (0.50) TP53PLA2G10PLA2G5SCN9ASCN10A

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
CN-102093285-B Cyclic amide derivatives, and their production and use as antithrombotic agents TAKEDA PHARMACEUTICAL 2013-10-16 CN disclosed
CN-1989104-B Cyclic amide derivatives, their preparation and their use as antithrombotic agents TAKEDA PHARMACEUTICAL 2011-07-13 CN disclosed
CN-102093285-A Cyclic amide derivatives, and their production and use as antithrombotic agents TAKEDA PHARMACEUTICAL 2011-06-15 CN disclosed
CN-1989104-A Cyclic amide derivatives, their preparation and their use as antithrombotic agents TAKEDA PHARMACEUTICAL (JP) 2007-06-27 CN disclosed