SCHEMBL15460244

SCHEMBL15460244

CC1(C)c2ccccc2-c2cc3c(-c4cccnc4)cc4oc5cc(-c6cccnc6)c6cc7c(cc6c5c4c3cc21)C(C)(C)c1ccccc1-7

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.40
CYP11B1 P15538 2/20 0.40
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
PTGS2 P35354 1/20 0.34
CYP11B2 P19099 1/20 0.34
KCNA3 P22001 1/20 0.34
BACE1 P56817 1/20 0.34
KCNH2 Q12809 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
TP53 P04637 2/20 0.34
CYP19A1 P11511 1/20 0.34
GAA P10253 1/20 0.34
KCNA5 P22460 1/20 0.34
PDE10A Q9Y233 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 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
SCHEMBL15460196 0.88 PDK2 (0.42) PDK2CYP11B1MAOAMAOBPTGS2
SCHEMBL15460325 0.85 PDK2 (0.40) PDK2CYP11B1PTGS2CYP11B2BACE1
SCHEMBL15460275 0.83 PDK2 (0.42) PDK2CYP11B1PTGS2CYP11B2BACE1
SCHEMBL14725779 0.83 CYP11B1 (0.48) PDK2CYP11B1MAOAMAOBPTGS2
SCHEMBL21180643 0.82 CYP11B1 (0.41) PDK2CYP11B1MAOAMAOBCYP11B2
SCHEMBL15461872 0.82 CYP11B1 (0.47) PDK2CYP11B1PTGS2CYP11B2CYP19A1
SCHEMBL14725773 0.78 PDK2 (0.42) PDK2CYP11B1PTGS2CYP11B2BACE1
SCHEMBL15460237 0.78 MAPT (0.38) MAOANPC1RAB9AMEN1KMT2A
SCHEMBL15462981 0.78 ABL1 (0.40) PDK2MAOBKCNH2NPC1RAB9A
SCHEMBL23258780 0.77 PDK2 (0.45) PDK2CYP11B1PTGS2CYP11B2BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9385327-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-05 US disclosed
US-9385327-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-05 US disclosed
US-9349966-B2 2016-05-24 US disclosed
US-9349966-B2 2016-05-24 US disclosed
US-20140034915-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO. LTD. (KR) 2014-02-06 US disclosed
US-20140034915-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO. LTD. (KR) 2014-02-06 US disclosed