SCHEMBL24883159

SCHEMBL24883159

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc(C4(c5ccccc5)c5ccccc5-c5ccccc54)c3)cc21

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNA1 P02708 1/20 0.32
CHRNG P07510 1/20 0.32
CHRNB1 P11230 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CHRND Q07001 1/20 0.32
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
PDK2 Q15119 2/20 0.32
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
CHRNA7 P36544 1/20 0.30

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
SCHEMBL19735414 0.96 CHRNA1 (0.31) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL16996087 0.95 LPL (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL23225108 0.94 PDK2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL24919718 0.94 PDK2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL24842958 0.94 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL23180676 0.94 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL24841529 0.93 PDK2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL24842972 0.93 PDK2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL24841642 0.93 PDK2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1
SCHEMBL24919715 0.93 PDK2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230009845-A1 ORGANIC ELECTRIC ELEMENT COMPRISING A PLURALITY OF EMISSION-AUXILIARY LAYERS AND ELECTRONIC DEVICE COMPRISING IT DUK SAN NEOLUX CO., LTD. (KR) 2023-01-12 US disclosed