SCHEMBL16017111

SCHEMBL16017111

c1ccc(-c2ccc3cc(Nc4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)ccc3c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.42
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 4/20 0.36
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
OPRK1 P41145 1/20 0.36
SNCA P37840 1/20 0.34
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
ABL1 P00519 1/20 0.33

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
SCHEMBL16017141 0.94 ALDH1A1 (0.46) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL16017060 0.93 PDK2 (0.45) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL31058366 0.91 ALDH1A1 (0.44) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL27309907 0.91 ALDH1A1 (0.44) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL15003689 0.90 PDK2 (0.50) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL20435268 0.90 PDK2 (0.50) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL29634238 0.90 PDK2 (0.50) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL17194800 0.89 PDK2 (0.47) PDK2ALDH1A1MEN1KMT2APOLB
SCHEMBL15677716 0.89 ALDH1A1 (0.53) PDK2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL30455829 0.89 ALDH1A1 (0.53) PDK2ALDH1A1CYP3A4HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9601703-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-9601703-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-9590185-B2 Amine-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-07 US disclosed
US-9590185-B2 Amine-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-07 US disclosed
US-9515265-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-06 US disclosed
US-9515265-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-06 US disclosed
US-20150236266-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-20 US disclosed
US-20150236266-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-20 US disclosed
US-20150053942-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-02-26 US disclosed
US-20150053942-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-02-26 US disclosed
US-20140252327-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-09-11 US disclosed
US-20140252327-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-09-11 US disclosed