SCHEMBL365039

SCHEMBL365039

CN(C)CCOC(=O)c1c2ccc(C(=O)CCN(C)C)cc2n2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 3/20 0.45
KDM4E B2RXH2 3/20 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
TDP1 Q9NUW8 1/20 0.42
RAD52 P43351 2/20 0.41
GAA P10253 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
POLR1A O95602 1/20 0.41
POLB P06746 1/20 0.40
PHLPP2 Q6ZVD8 1/20 0.40
LMNA P02545 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
SCHEMBL364774 0.94 ALDH1A1 (0.43) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL364767 0.93 MAPT (0.43) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL366311 0.91 TDP1 (0.49) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL364913 0.91 ALDH1A1 (0.44) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL365803 0.91 ALDH1A1 (0.42) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL364336 0.90 ALDH1A1 (0.41) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL365410 0.89 ALDH1A1 (0.46) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL365387 0.88 ALDH1A1 (0.46) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL366409 0.88 ALDH1A1 (0.42) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL364891 0.87 MAPT (0.44) MAPTKMT2AALDH1A1MEN1KDM4E

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 3 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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed