SCHEMBL365440

SCHEMBL365440

CCS(=O)(=O)NC(=O)c1c2ccc(C(C)=O)cc2n2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
SAE1 Q9UBE0 2/20 0.41
UBA2 Q9UBT2 2/20 0.41
APAF1 O14727 1/20 0.41
G6PD P11413 1/20 0.41
PABPC1 P11940 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
TP53 P04637 4/20 0.36
HPGD P15428 5/20 0.36
BAZ2B Q9UIF8 4/20 0.36
BAZ2A Q9UIF9 4/20 0.36
BRD9 Q9H8M2 2/20 0.36
LMNA P02545 1/20 0.36
XBP1 P17861 1/20 0.36
MPI P34949 1/20 0.36

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
SCHEMBL366252 0.92 ALDH1A1 (0.39) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL364815 0.91 PTPN1 (0.39) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL366209 0.89 HPGD (0.46) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL366977 0.88 SCN9A (0.46) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL366382 0.87 HPGD (0.38) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL366059 0.83 S1PR3 (0.38) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL365519 0.83 KMT2A (0.45) MAPTKMT2AMEN1TP53HPGD
SCHEMBL365441 0.81 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDLMNASMN1; SMN2
SCHEMBL367568 0.81 ALDH1A1 (0.44) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL365931 0.81 MAPT (0.47) MAPTALDH1A1TP53HPGD

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