SCHEMBL366273

SCHEMBL366273

CCOC(=O)c1c2ccccc2n2cc(OCc3c(F)cccc3F)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.45
KMT2A Q03164 5/20 0.45
ALDH1A1 P00352 5/20 0.45
MAPT P10636 4/20 0.45
MEN1 O00255 4/20 0.45
SAE1 Q9UBE0 2/20 0.45
UBA2 Q9UBT2 2/20 0.45
APAF1 O14727 1/20 0.45
G6PD P11413 1/20 0.45
PABPC1 P11940 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
TP53 P04637 1/20 0.45
THRB P10828 1/20 0.45
ALOX5 P09917 2/20 0.42
PTGES O14684 1/20 0.42
CFTR P13569 2/20 0.41
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
XBP1 P17861 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
SCHEMBL364936 0.93 ALDH1A1 (0.44) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL364702 0.88 KDM4E (0.45) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL364674 0.85 KDM4E (0.48) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL366971 0.85 MAPT (0.48) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL366352 0.84 KMT2A (0.44) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL366272 0.84 ALDH1A1 (0.65) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL364784 0.83 KDM4E (0.47) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL364182 0.82 MAOB (0.46) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL364482 0.82 KDM4E (0.48) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL366340 0.82 MAOB (0.49) KDM4EKMT2AALDH1A1MAPTMEN1

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