SCHEMBL24969738

SCHEMBL24969738

CC1(C)c2ccccc2-c2ccc(Nc3ccc(C45CC6CC(C4)C(C6)C5)cc3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.39
NPC1 O15118 1/20 0.39
EPHX2 P34913 8/20 0.37
LMNA P02545 3/20 0.37
MAPT P10636 2/20 0.37
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.31
GFER P55789 2/20 0.31
KMT2A Q03164 2/20 0.31
MDH1 P40925 1/20 0.31
MDH2 P40926 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
RAD52 P43351 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PGR P06401 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
SCHEMBL22815548 0.94 NPC1 (0.44) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL23600813 0.83 NPC1 (0.41) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL23600770 0.83 EPHX2 (0.40) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL22815531 0.82 PDK2 (0.34) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL25872113 0.81 PDK2 (0.38) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL23205969 0.81 PDK2 (0.38) PDK2
SCHEMBL30691808 0.81 NPC1 (0.38) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL26983130 0.81 NPC1 (0.38) PDK2NPC1EPHX2LMNAMAPT
SCHEMBL27393078 0.81 PDK2 (0.39) PDK2LMNAMAPTALDH1A1MEN1
SCHEMBL27382638 0.81 PDK2 (0.34) PDK2NPC1EPHX2LMNAMAPT

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
WO-2024096383-A1 ORGANIC ELECTRONIC DEVICE COMPRISING PLURALITY OF LIGHT-EMITTING AUXILIARY LAYERS, AND ELECTRONIC APPARATUS THEREFOR 덕산네오룩스 주식회사 2024-05-10 WO disclosed
WO-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 WO disclosed