SCHEMBL367089

SCHEMBL367089

CCOC(=O)c1c2ccccc2n2cc(OCC(=O)N(C)C)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.52
ALDH1A1 P00352 6/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 4/20 0.52
MEN1 O00255 3/20 0.52
SAE1 Q9UBE0 2/20 0.52
UBA2 Q9UBT2 2/20 0.52
APAF1 O14727 1/20 0.52
G6PD P11413 1/20 0.52
PABPC1 P11940 1/20 0.52
CACNA1B Q00975 1/20 0.52
APBA1 Q02410 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
XBP1 P17861 1/20 0.45
MPI P34949 1/20 0.45
GAA P10253 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL366987 0.89 KDM4E (0.53) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL364878 0.89 SMN1; SMN2 (0.55) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL365760 0.89 KDM4E (0.53) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL364876 0.87 KDM4E (0.52) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL364682 0.86 KMT2A (0.58) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL364802 0.85 KDM4E (0.49) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL364969 0.83 KDM4E (0.53) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL366971 0.83 MAPT (0.48) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL365439 0.83 KDM4E (0.48) KDM4EALDH1A1KMT2AMAPTMEN1
SCHEMBL367088 0.83 ALDH1A1 (0.74) KDM4EALDH1A1KMT2AMAPTMEN1

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