SCHEMBL26157463

SCHEMBL26157463

CC1(C)c2ccccc2-c2cc(C3(c4ccccc4)c4ccccc4-c4cc(Br)ccc43)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
OPRK1 P41145 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
PDK2 Q15119 3/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 1/20 0.36
POLB P06746 1/20 0.35
PDE4B Q07343 1/20 0.34
PTPRC P08575 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PGR P06401 1/20 0.31
ALK Q9UM73 1/20 0.30
CYP19A1 P11511 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
SCHEMBL15551440 0.88 MEN1 (0.53) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL29535882 0.88 MEN1 (0.53) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL16852582 0.85 MEN1 (0.49) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL29564362 0.84 PDK2 (0.46) PDK2OPRM1PDE4BPTPRCTDP1
SCHEMBL806937 0.84 PDK2 (0.46) PDK2OPRM1PDE4BPTPRCTDP1
SCHEMBL18864169 0.84 MEN1 (0.50) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL25937351 0.83 PTPRC (0.46) PDK2OPRM1PDE4BPTPRCTDP1
SCHEMBL18032791 0.83 KDM4E (0.44) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL32659699 0.82 MEN1 (0.49) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL16922974 0.82 ESR1 (0.45) MEN1KMT2AKDM4ELMNAMAPT

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
WO-2023096210-A1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2023-06-01 WO disclosed