SCHEMBL29986604

SCHEMBL29986604

c1ccc(-c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(-c7ccccc7)cc6)ccc5-4)c4cc(-c5ccc(-c6ccccc6)cc5)ccc4-c4ccc(-c5ccc(-c6ccccc6)cc5)cc43)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.55
TDP2 O95551 1/20 0.47
MEN1 O00255 1/20 0.47
APAF1 O14727 1/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
XBP1 P17861 1/20 0.47
PTBP1 P26599 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
GALK1 P51570 1/20 0.47
BLM P54132 1/20 0.47
SMAD3 P84022 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL290998 1.00 PDK2 (0.55) PDK2TDP2MEN1APAF1NPC1
SCHEMBL545091 1.00 PDK2 (0.55) PDK2TDP2MEN1APAF1NPC1
SCHEMBL5859662 0.94 PDK2 (0.59) PDK2TDP2MEN1APAF1NPC1
SCHEMBL25685038 0.94 PDK2 (0.59) PDK2TDP2MEN1APAF1NPC1
SCHEMBL5859559 0.94 PDK2 (0.59) PDK2TDP2MEN1APAF1NPC1
SCHEMBL4321761 0.94 PDK2 (0.59) PDK2TDP2MEN1APAF1NPC1
SCHEMBL25584086 0.90 PDK2 (0.56) PDK2TDP2MEN1APAF1NPC1
SCHEMBL22838057 0.90 PDK2 (0.56) PDK2TDP2MEN1APAF1NPC1
SCHEMBL6863550 0.89 PDK2 (0.46) PDK2TDP2MEN1APAF1NPC1
SCHEMBL6294152 0.88 PDK2 (0.53) PDK2MEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3477722-B1 LIGHT ABSORBER AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2023-09-27 EP disclosed
CN-109516992-B Nitrogen-containing compound and organic electroluminescent device comprising same 三星显示有限公司 2023-04-07 CN disclosed
CN-107868097-B Amine compound and organic electroluminescent device including the same 三星显示有限公司 2022-10-18 CN disclosed