SCHEMBL17243271

SCHEMBL17243271

Cn1c(=O)n(CCc2ccc(Cl)cc2)c(=O)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MEN1 O00255 4/20 0.50
IDO1 P14902 1/20 0.48
ALDH1A1 P00352 1/20 0.43
MAPT P10636 2/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CYP1A2 P05177 1/20 0.42
SRC P12931 1/20 0.41
PRKACA P17612 1/20 0.41
PRKACG P22612 1/20 0.41
PRKACB P22694 1/20 0.41
NOX4 Q9NPH5 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 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
SCHEMBL12991217 0.89 POLB (0.49) KMT2AMEN1ALDH1A1MAPTHDAC1
SCHEMBL17241665 0.79 MAPT (0.56) KMT2AMEN1MAPTHDAC1HDAC8
SCHEMBL17241980 0.77 MAPT (0.52) KMT2AMEN1IDO1ALDH1A1MAPT
SCHEMBL17242527 0.76 KMT2A (0.54) KMT2AMEN1HDAC1HDAC8HDAC6
SCHEMBL17241832 0.75 PLK1 (0.45) KMT2AMEN1MAPTHDAC1HDAC8
SCHEMBL17241739 0.75 MAPT (0.42) KMT2AMEN1IDO1ALDH1A1MAPT
SCHEMBL17241741 0.75 MAPT (0.42) KMT2AMEN1IDO1ALDH1A1MAPT
SCHEMBL6510739 0.75 KMT2A (0.72) KMT2AMEN1ALDH1A1MAPTHDAC1
SCHEMBL6509732 0.70 MEN1 (0.60) KMT2AMEN1MAPTHDAC1TP53
SCHEMBL7708920 0.69 MAPT (0.67) KMT2AMEN1ALDH1A1MAPTCYP1A2

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
EP-3140301-A1 PHARMACOLOGICALLY ACTIVE QUINAZOLINEDIONE DERIVATIVES Orion Corporation (FI) 2017-03-15 EP claimed
WO-2015169999-A1 PHARMACOLOGICALLY ACTIVE QUINAZOLINEDIONE DERIVATIVES ORION CORPORATION (FI) 2015-11-12 WO claimed