SCHEMBL364682

SCHEMBL364682

CCOC(=O)c1c2ccccc2n2cc(OCCN(C)C)ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
HPGD P15428 2/20 0.58
POLB P06746 3/20 0.47
GAA P10253 3/20 0.47
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 7/20 0.46
MAPT P10636 4/20 0.46
SAE1 Q9UBE0 2/20 0.46
UBA2 Q9UBT2 2/20 0.46
APAF1 O14727 1/20 0.46
G6PD P11413 1/20 0.46
PABPC1 P11940 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
LMNA P02545 2/20 0.41
XBP1 P17861 1/20 0.41
MPI P34949 1/20 0.41
HTT P42858 1/20 0.40
ELANE P08246 1/20 0.40

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
SCHEMBL365439 0.87 KDM4E (0.48) KMT2AMEN1HPGDPOLBGAA
SCHEMBL367089 0.86 KDM4E (0.52) KMT2AMEN1HPGDPOLBGAA
SCHEMBL365609 0.85 ALDH1A1 (0.48) KMT2AMEN1HPGDALDH1A1KDM4E
SCHEMBL365132 0.85 ALDH1A1 (0.46) KMT2AMEN1HPGDPOLBGAA
SCHEMBL366836 0.84 ALDH1A1 (0.50) KMT2AMEN1HPGDPOLBGAA
SCHEMBL366943 0.84 KDM4E (0.46) KMT2AMEN1HPGDPOLBGAA
SCHEMBL364443 0.83 ALDH1A1 (0.45) KMT2AMEN1HPGDPOLBGAA
SCHEMBL365760 0.83 KDM4E (0.53) KMT2AMEN1HPGDPOLBGAA
SCHEMBL366987 0.83 KDM4E (0.53) KMT2AMEN1HPGDGAAALDH1A1
SCHEMBL364878 0.83 SMN1; SMN2 (0.55) KMT2AMEN1HPGDPOLBGAA

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-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed