SCHEMBL23105484

SCHEMBL23105484

CCc1nc2ccccc2n1-c1ccc(-c2cccc3c(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)cccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
PDE10A Q9Y233 3/20 0.39
CYP1A2 P05177 1/20 0.39
MAPK1 P28482 2/20 0.39
FLT3 P36888 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 2/20 0.36
PABPC1 P11940 1/20 0.36
RECQL P46063 1/20 0.36
ENPP3 O14638 1/20 0.36
ENPP1 P22413 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL23105490 0.96 MEN1 (0.43) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL23105486 0.94 MEN1 (0.46) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL23105483 0.93 MEN1 (0.45) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL23099254 0.92 MEN1 (0.42) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL23105485 0.89 MEN1 (0.42) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL2604848 0.87 KDM4E (0.42) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL25861981 0.87 ESR1 (0.42) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL25769002 0.86 MEN1 (0.51) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL25864801 0.85 ESR1 (0.41) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL23105482 0.84 ALDH1A1 (0.45) MEN1KMT2AKDM4EALDH1A1MAPT

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-2021049843-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-03-18 WO disclosed