SCHEMBL9912909

SCHEMBL9912909

COc1ccc(N(c2ccccc2)c2ccc(-n3c4ccc(N(c5ccccc5)c5ccc(OC)cc5)cc4c4cc(N(c5ccccc5)c5ccc(OC)cc5)ccc43)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
MAPT P10636 7/20 0.46
HTT P42858 4/20 0.46
LMNA P02545 1/20 0.44
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
HPGD P15428 5/20 0.43
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HSD17B10 Q99714 2/20 0.42
PKM P14618 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TP53 P04637 3/20 0.42
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EDNRA P25101 1/20 0.40

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
SCHEMBL4843245 1.00 KDM4E (0.47) KDM4EMAPTHTTLMNAMEN1
SCHEMBL9912937 0.94 MAPT (0.46) KDM4EMAPTHTTLMNAMEN1
SCHEMBL17414859 0.94 MAPT (0.46) KDM4EMAPTHTTLMNAMEN1
SCHEMBL17485891 0.94 MAPT (0.46) KDM4EMAPTHTTLMNAMEN1
SCHEMBL12299178 0.93 MAPT (0.48) KDM4EMAPTHTTLMNAMEN1
SCHEMBL10025011 0.92 KDM4E (0.48) KDM4EMAPTHTTLMNAMEN1
SCHEMBL9912969 0.92 KDM4E (0.45) KDM4EMAPTHTTMEN1KMT2A
SCHEMBL8928090 0.92 MAPT (0.49) KDM4EMAPTHTTLMNAMEN1
SCHEMBL8928202 0.92 MAPT (0.49) KDM4EMAPTHTTLMNAMEN1
SCHEMBL9912970 0.92 KDM4E (0.45) KDM4EMAPTHTTMEN1KMT2A

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