SCHEMBL366192

SCHEMBL366192

COC(C)N(C)CC(=O)c1c2ccc(C(C)=O)cc2n2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
HPGD P15428 3/20 0.38
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 4/20 0.36
SAE1 Q9UBE0 2/20 0.36
UBA2 Q9UBT2 2/20 0.36
APAF1 O14727 1/20 0.36
G6PD P11413 1/20 0.36
PABPC1 P11940 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
BAZ2B Q9UIF8 5/20 0.33
BAZ2A Q9UIF9 5/20 0.33
IDO1 P14902 1/20 0.32
LMNA P02545 1/20 0.32
XBP1 P17861 1/20 0.32
MPI P34949 1/20 0.32
GFER P55789 1/20 0.32

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
SCHEMBL366837 0.85 ALDH1A1 (0.40) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL366193 0.82 ALDH1A1 (0.36) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL364304 0.80 CHRM1 (0.38) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL366441 0.79 ALDH1A1 (0.43) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL366185 0.78 CYP1A2 (0.42) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL364388 0.78 ALDH1A1 (0.43) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL367568 0.77 ALDH1A1 (0.44) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL364280 0.77 MAPT (0.47) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL366238 0.76 CYP1A2 (0.44) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL367618 0.75 BAZ2B (0.38) ALDH1A1HPGDMEN1KMT2AMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

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