SCHEMBL364802

SCHEMBL364802

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.49
ALDH1A1 P00352 9/20 0.49
HPGD P15428 5/20 0.49
MAPT P10636 4/20 0.49
TSHR P16473 2/20 0.49
HSD17B10 Q99714 2/20 0.49
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 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
GAA P10253 3/20 0.44
HTT P42858 2/20 0.44
RCE1 Q9Y256 1/20 0.44
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL366638 0.87 KDM4E (0.47) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL367142 0.87 KDM4E (0.47) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL366406 0.87 GABRP (0.41) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL367089 0.85 KDM4E (0.52) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL366828 0.84 PKM (0.46) ALDH1A1TSHRKMT2AGAAPKM
SCHEMBL364969 0.84 KDM4E (0.53) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL367283 0.83 RAB9A (0.44) ALDH1A1TSHRKMT2AGAAPKM
SCHEMBL364682 0.82 KMT2A (0.58) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL364801 0.82 ALDH1A1 (0.64) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL364758 0.81 MEN1 (0.44) KDM4EALDH1A1MAPTTSHRKMT2A

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