SCHEMBL14644544

SCHEMBL14644544

c1ccc(-c2ccc(-c3ccc4c5cc6ccccc6cc5c5nc6ccccc6n5c4c3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.55
ALDH1A1 P00352 6/20 0.55
HPGD P15428 6/20 0.55
KMT2A Q03164 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 4/20 0.46
LMNA P02545 3/20 0.46
POLB P06746 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 3/20 0.43
TYMS P04818 1/20 0.42
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
ADORA2A P29274 1/20 0.40
FLT3 P36888 1/20 0.39
MAOA P21397 2/20 0.39

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
SCHEMBL14644082 0.95 ALDH1A1 (0.50) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL14643567 0.93 HPGD (0.47) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL10023097 0.92 ALDH1A1 (0.57) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL10023094 0.92 KDM4E (0.57) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL14644549 0.91 HPGD (0.48) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL10023358 0.91 HPGD (0.51) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL14644078 0.91 HPGD (0.51) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL18069097 0.91 ALDH1A1 (0.51) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL20090153 0.89 ALDH1A1 (0.44) KDM4EALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL14644083 0.89 ALDH1A1 (0.44) KDM4EALDH1A1HPGDKMT2ASMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9000169-B2 Compounds and organic electronic device using the same LG CHEM, LTD. (KR) 2015-04-07 US disclosed
US-9000169-B2 Compounds and organic electronic device using the same LG CHEM, LTD. (KR) 2015-04-07 US disclosed
US-20130181196-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2013-07-18 US disclosed
US-20130181196-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2013-07-18 US disclosed
WO-2013009013-A2 NOVEL COMPOUND AND ORGANIC ELECTRONIC DEVICE USING SAME 주식회사 엘지화학 (KR) 2013-01-17 WO disclosed