SCHEMBL6757243

SCHEMBL6757243

Nc1c(C=O)c(C=O)c2cc3ccccc3cc2c1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.39
PI4KA P42356 1/20 0.38
PI4K2B Q8TCG2 1/20 0.38
PI4K2A Q9BTU6 1/20 0.38
PI4KB Q9UBF8 1/20 0.38
CYP2A6 P11509 3/20 0.36
KDM4E B2RXH2 3/20 0.35
THRB P10828 1/20 0.35
ALDH1A1 P00352 4/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 2/20 0.34
PADI4 Q9UM07 1/20 0.34
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HBB P68871 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL30662748 0.83 ERN1 (0.47) ERN1CYP2A6KDM4ETHRBALDH1A1
SCHEMBL548345 0.83 ERN1 (0.47) ERN1CYP2A6KDM4ETHRBALDH1A1
SCHEMBL9883837 0.81 ERN1 (0.48) ERN1CYP2A6KDM4ETHRBALDH1A1
SCHEMBL547859 0.79 ERN1 (0.44) ERN1CYP2A6KDM4ETHRBALDH1A1
SCHEMBL548819 0.79 ERN1 (0.44) ERN1CYP2A6KDM4ETHRBALDH1A1
SCHEMBL11483755 0.77 ERN1 (0.50) ERN1CYP2A6ALDH1A1HSD17B10PADI4
SCHEMBL2321929 0.76 ALDH1A1 (0.48) PI4KAPI4K2BPI4K2API4KBCYP2A6
SCHEMBL15453252 0.74 ERN1 (0.37) ERN1PI4KAPI4K2BPI4K2API4KB
SCHEMBL10348702 0.73 ERN1 (0.55) ERN1CYP2A6KDM4EALDH1A1CYP3A4
SCHEMBL19253219 0.72 ALDH1A1 (0.44) PI4KAPI4K2BPI4K2API4KBCYP2A6

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
US-20040023062-A1 An anode, a layer of a hole transporting material which emits light in the blue spectrum, a layer of an organo metallic complex and a cathode; emits white light ELAM-T LIMITED 2004-02-05 US disclosed
EP-1336325-A1 ELECTROLUMINESCENT DEVICE Elam-T Limited (GB) 2003-08-20 EP disclosed
WO-2002043446-A1 ELECTROLUMINESCENT DEVICE ELAM-T LIMIED (GB) 2002-05-30 WO disclosed