SCHEMBL10330893

SCHEMBL10330893

N#Cc1cccc(-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
DRD2 P14416 2/20 0.43
DRD3 P35462 1/20 0.43
RPS6KB1 P23443 1/20 0.43
NOTUM Q6P988 1/20 0.42
MAT2A P31153 2/20 0.39
GRM5 P41594 6/20 0.39
RORC P51449 1/20 0.38
NSD2 O96028 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL25905725 0.97 KDM4E (0.44) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL29501302 0.94 KDM4E (0.53) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL1201648 0.94 KDM4E (0.53) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL18381882 0.92 KDM4E (0.52) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL18347489 0.91 KDM4E (0.42) KDM4EATML3MBTL1RPS6KB1GRM5
SCHEMBL15250593 0.91 KDM4E (0.44) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL20621594 0.91 KDM4E (0.39) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL18633431 0.90 KDM4E (0.45) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL20708721 0.89 KDM4E (0.38) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL9883349 0.89 KDM4E (0.55) KDM4EATML3MBTL1RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426042-B2 Material for organic electroluminescence device, and organic electroluminescence device UDC IRELAND LIMITED (IE) 2013-04-23 US disclosed
US-8426042-B2 Material for organic electroluminescence device, and organic electroluminescence device UDC IRELAND LIMITED (IE) 2013-04-23 US disclosed
US-20120181528-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-07-19 US disclosed
US-20120181528-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-07-19 US disclosed