SCHEMBL24255700

SCHEMBL24255700

c1ccc(-c2cccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
ESR1 P03372 3/20 0.33
ESR2 Q92731 3/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA3 P32297 2/20 0.33
CHRNA4 P43681 2/20 0.33
CHRNA1 P02708 1/20 0.33
CHRNG P07510 1/20 0.33
CHRNB1 P11230 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CHRND Q07001 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 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
SCHEMBL23224709 1.00 PDK2 (0.35) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24918523 1.00 PDK2 (0.35) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24841864 0.99 PDK2 (0.34) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24841372 0.99 PDK2 (0.34) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24841957 0.99 PDK2 (0.34) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24842836 0.99 PDK2 (0.34) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24841668 0.99 PDK2 (0.34) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24919200 0.99 PDK2 (0.36) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL24919174 0.99 HSD17B1 (0.35) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL23224402 0.99 PDK2 (0.36) PDK2HSD17B1HSD17B2ESR1ESR2

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
US-20230337529-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2023-10-19 US disclosed
US-20230337529-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2023-10-19 US disclosed
WO-2022035097-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER 엘티소재주식회사 2022-02-17 WO disclosed