SCHEMBL4573534

SCHEMBL4573534

CC(C)(C)OC(=O)CC1CCN(N)C1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4D Q6B0I6 1/20 0.37
NR1H2 P55055 1/20 0.36
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
BRD4 O60885 1/20 0.33
CTSK P43235 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
GLS O94925 2/20 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
SCHEMBL8130203 0.90 PLA2G10 (0.35) KDM4DNR1H2KDM4EPKMBRD4
SCHEMBL31588543 0.79 NR1H2 (0.48) NR1H2KDM4EPKMALDH1A1KMT2A
SCHEMBL31189316 0.79 NR1H2 (0.48) NR1H2KDM4EPKMALDH1A1KMT2A
SCHEMBL25957458 0.79 NR1H2 (0.48) NR1H2KDM4EPKMALDH1A1KMT2A
SCHEMBL14086999 0.77 GPR119 (0.42) KDM4DNR1H2ALDH1A1
SCHEMBL1932287 0.77 NR1H2 (0.41) NR1H2BRD4CTSKALDH1A1KMT2A
SCHEMBL6608848 0.75 HPGD (0.53) NR1H2KDM4EPKMMAPTHPGD
SCHEMBL14146004 0.75 GLS (0.39) NR1H2KDM4EPKMHPGDGLS
SCHEMBL18053194 0.75 GLS (0.37) KDM4DNR1H2ALDH1A1KMT2AMEN1
SCHEMBL2862919 0.75 GLS (0.37) NR1H2KDM4EPKMHPGDGLS

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
WO-2008062013-A1 PREPARATION OF 4-SUBSTITUTED 2-AMINO-BENZO[4,5]FURO [3,2-D]PYRIMIDINE DERIVATIVES CELLZOME LIMITED (GB) 2008-05-29 WO disclosed
EP-1925619-A1 Preparation of 4-substituted 2-amino-benzo[4,5]furo[3,2-d]pyrimidine derivatives Cellzome (UK) Ltd. (GB) 2008-05-28 EP disclosed