SCHEMBL15319971

SCHEMBL15319971

CCOC(=O)OC1CCCN(CC2CCCCC2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
ALDH1A1 P00352 8/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
BDKRB2 P30411 1/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 2/20 0.34
TSHR P16473 2/20 0.34
CYP2D6 P10635 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
PLA2G1B P04054 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
MEN1 O00255 1/20 0.34
OPRD1 P41143 1/20 0.33
AR P10275 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL15325151 0.79 TLR4 (0.42) LMNAALDH1A1KMT2ATSHRMEN1
SCHEMBL8948383 0.72 CHRM2 (0.55)
SCHEMBL8948436 0.72 CHRM2 (0.55)
SCHEMBL15319926 0.72 ALDH1A1 (0.46) LMNAALDH1A1KMT2AMEN1KDM4E
SCHEMBL15320766 0.72 HSD11B1 (0.38) LMNAALDH1A1L3MBTL1THRBATM
SCHEMBL15319587 0.71 CASP3 (0.46) LMNAALDH1A1ATMKMT2AMEN1
SCHEMBL10361297 0.70 CYP2D6 (0.51) LMNAALDH1A1KMT2APOLBCYP2D6
SCHEMBL15320765 0.68 BDKRB2 (0.39) LMNAALDH1A1L3MBTL1THRBATM
SCHEMBL8848123 0.68 CHRM2 (0.39)
SCHEMBL8847918 0.68 CHRM2 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2834221-B1 CYCLIC AMIDES AS METAP-2 INHIBITORS MERCK PATENT GMBH (DE) 2016-05-25 EP disclosed
EP-2834221-A1 CYCLIC AMIDES AS METAP-2 INHIBITORS Merck Patent GmbH (DE) 2015-02-11 EP disclosed
WO-2013149704-A1 CYCLIC AMIDES AS METAP-2 INHIBITORS MERCK PATENT GMBH (DE) 2013-10-10 WO disclosed