SCHEMBL16807014

SCHEMBL16807014

N#Cc1ccc2c3cc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)ccc3n(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.39
PDPK1 O15530 1/20 0.37
TDP2 O95551 10/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PTGER4 P35408 1/20 0.34
CYP1A2 P05177 4/20 0.33
MEN1 O00255 3/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP3A4 P08684 3/20 0.33
KMT2A Q03164 3/20 0.33
LMNA P02545 3/20 0.33
CYP2C19 P33261 2/20 0.33
CLK4 Q9HAZ1 2/20 0.33
CYP2D6 P10635 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C9 P11712 1/20 0.33
TP53 P04637 2/20 0.32

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
SCHEMBL16809815 0.95 PIM1 (0.40) PIM1PDPK1TDP2CA1CA2
SCHEMBL16809843 0.91 PIM1 (0.39) PIM1PDPK1TDP2CA1CA2
SCHEMBL16807017 0.91 TDP2 (0.38) PIM1PDPK1TDP2CA1CA2
SCHEMBL16809816 0.86 CYP1A2 (0.39) PIM1PDPK1TDP2CA1CA2
SCHEMBL16809819 0.86 CYP1A2 (0.38) PIM1TDP2CA1CA2PTGER4
SCHEMBL16809845 0.85 PDPK1 (0.39) PDPK1TDP2CA1CA2PTGER4
SCHEMBL16807015 0.84 TDP2 (0.40) PDPK1TDP2CA1CA2PTGER4
SCHEMBL16809520 0.84 CYP1A2 (0.36) PDPK1TDP2CA1CA2CYP1A2
SCHEMBL16809575 0.83 CYP1A2 (0.40) PDPK1CA1CA2CYP1A2MEN1
SCHEMBL24810925 0.83 KDM4E (0.34) PIM1PTGER4MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9705088-B2 Triazine-based compounds and organic light-emitting devices including triazine-based compounds SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-9705088-B2 Triazine-based compounds and organic light-emitting devices including triazine-based compounds SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-20150171336-A1 TRIAZINE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING TRIAZINE-BASED COMPOUNDS SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-18 US disclosed
US-20150171336-A1 TRIAZINE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING TRIAZINE-BASED COMPOUNDS SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-18 US disclosed