SCHEMBL366352

SCHEMBL366352

CCOC(=O)c1c2ccccc2n2cc(OCc3cc(F)ccc3F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
MAPT P10636 5/20 0.44
KDM4E B2RXH2 5/20 0.44
MEN1 O00255 4/20 0.44
ALDH1A1 P00352 4/20 0.44
SAE1 Q9UBE0 2/20 0.44
UBA2 Q9UBT2 2/20 0.44
APAF1 O14727 1/20 0.44
G6PD P11413 1/20 0.44
PABPC1 P11940 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
ELANE P08246 2/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 2/20 0.41
ALKBH1 Q13686 1/20 0.41
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 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
SCHEMBL364674 0.86 KDM4E (0.48) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL366351 0.86 ALDH1A1 (0.62) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL366273 0.84 KDM4E (0.45) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL366971 0.81 MAPT (0.48) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL366340 0.80 MAOB (0.49) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL364936 0.80 ALDH1A1 (0.44) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL365719 0.80 MAPT (0.48) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL364784 0.80 KDM4E (0.47) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL364519 0.80 MAPT (0.43) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL364182 0.79 MAOB (0.46) KMT2AMAPTKDM4EMEN1ALDH1A1

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