SCHEMBL29314792

SCHEMBL29314792

c1ccc(-c2cnc3c(ccc4ccc(-c5ccc(-c6cccc(-c7ccc8ccc9ccc(-c%10ccccc%10)nc9c8n7)c6)cc5)nc43)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
PARP1 P09874 3/20 0.46
CYP11B1 P15538 3/20 0.44
CYP11B2 P19099 3/20 0.44
AXL P30530 2/20 0.42
CDK8 P49336 2/20 0.42
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
CYP17A1 P05093 1/20 0.37
CYP19A1 P11511 1/20 0.37
MAP3K11 Q16584 1/20 0.37
TNIK Q9UKE5 1/20 0.37
BIRC5 O15392 1/20 0.37
PIM1 P11309 1/20 0.37

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
SCHEMBL29314796 1.00 KDM4E (0.51) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL17899317 0.98 KDM4E (0.53) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL26364628 0.97 KDM4E (0.50) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL17899321 0.97 KDM4E (0.54) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL18806866 0.95 KDM4E (0.55) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL25850634 0.95 KDM4E (0.51) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL29250321 0.92 KDM4E (0.54) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL14900765 0.89 KDM4E (0.47) KDM4EPARP1CYP11B1CYP11B2AXL
SCHEMBL21103678 0.88 CYP1A1 (0.49) PARP1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL21103640 0.88 CYP1A1 (0.49) PARP1CYP11B1CYP11B2HSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240244968-A1 ORGANIC LIGHT EMITTING ELEMENT AND DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed
US-20240244968-A1 ORGANIC LIGHT EMITTING ELEMENT AND DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed