SCHEMBL9912935

SCHEMBL9912935

COc1cccc(N(c2ccc(-n3c4ccc(N(c5cccc(OC)c5)c5cccc(OC)c5)cc4c4cc(N(c5cccc(OC)c5)c5cccc(OC)c5)ccc43)cc2)c2cccc(OC)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
HTT P42858 4/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MTNR1A P48039 4/20 0.38
MTNR1B P49286 4/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 2/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALOX15 P16050 2/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PPARG P37231 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL9912970 0.97 KDM4E (0.45) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912969 0.97 KDM4E (0.45) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912908 0.97 KDM4E (0.45) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL12856848 0.93 KDM4E (0.49) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912897 0.92 MTNR1A (0.43) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912985 0.91 MTNR1A (0.42) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912924 0.91 KDM4E (0.44) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912936 0.91 KDM4E (0.41) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912963 0.89 KDM4E (0.38) KDM4EHTTMAPTMEN1KMT2A
SCHEMBL9912946 0.89 KDM4E (0.41) KDM4EHTTMAPTMEN1KMT2A

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