SCHEMBL9912959

SCHEMBL9912959

COc1ccc(N(c2ccc(OC)cc2)c2cc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc(-n3c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4c4cc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)ccc43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.39
MAPT P10636 4/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 2/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
POLB P06746 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGER4 P35408 1/20 0.34
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34

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
SCHEMBL9912947 0.94 KDM4E (0.42) HTTMAPTHPGDHSD17B10PKM
SCHEMBL9912963 0.92 KDM4E (0.38) HTTMAPTHPGDHSD17B10PKM
SCHEMBL9912955 0.91 CYP1A2 (0.41) HTTMAPTHPGDHSD17B10PKM
SCHEMBL17485891 0.91 MAPT (0.46) HTTMAPTHPGDHSD17B10PKM
SCHEMBL9912937 0.91 MAPT (0.46) HTTMAPTHPGDHSD17B10PKM
SCHEMBL17414859 0.91 MAPT (0.46) HTTMAPTHPGDHSD17B10PKM
SCHEMBL9912938 0.88 KDM4E (0.41) HTTMAPTHPGDHSD17B10PKM
SCHEMBL17414864 0.87 MAPT (0.43) HTTMAPTHPGDHSD17B10PKM
SCHEMBL9912946 0.86 KDM4E (0.41) HTTMAPTHPGDHSD17B10ALOX15
SCHEMBL24688571 0.86 KDM4E (0.48) HTTMAPTHPGDHSD17B10SMN1; SMN2

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
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed