SCHEMBL366405

SCHEMBL366405

C=CCOC(=O)c1c2ccc(OC(=O)N(C)C)cc2n2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.50
ALDH1A1 P00352 9/20 0.50
MEN1 O00255 8/20 0.50
KDM4E B2RXH2 7/20 0.50
MAPT P10636 6/20 0.50
SAE1 Q9UBE0 2/20 0.50
UBA2 Q9UBT2 2/20 0.50
PABPC1 P11940 2/20 0.50
APAF1 O14727 1/20 0.50
G6PD P11413 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
HPGD P15428 3/20 0.46
LMNA P02545 3/20 0.46
XBP1 P17861 1/20 0.46
MPI P34949 1/20 0.46
GAA P10253 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL364801 0.88 ALDH1A1 (0.64) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL366406 0.84 GABRP (0.41) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL10274108 0.82 ALDH1A1 (0.57) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL366827 0.82 KMT2A (0.45) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL365561 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL367282 0.81 KMT2A (0.47) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL366560 0.80 KDM4E (0.47) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL365116 0.80 ALDH1A1 (0.52) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL367141 0.76 ALDH1A1 (0.67) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL366637 0.76 ALDH1A1 (0.67) KMT2AALDH1A1MEN1KDM4EMAPT

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 5 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-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed