SCHEMBL22869035

SCHEMBL22869035

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6ccc7c(c6c5)-c5ccccc5C7(c5ccccc5)c5ccccc5)c4)n3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 3/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GP6 Q9HCN6 1/20 0.33
PLG P00747 1/20 0.33
PLAU P00749 1/20 0.33
OPRK1 P41145 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 3/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ATM Q13315 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL22868634 0.99 MAPT (0.34) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL22868963 0.96 MEN1 (0.36) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL22868514 0.96 MEN1 (0.36) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL22868959 0.95 MEN1 (0.36) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL21394017 0.93 MAPT (0.35) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL21394307 0.93 MAPT (0.35) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL21394118 0.93 MAPT (0.35) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL21394371 0.93 MAPT (0.35) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL21394305 0.93 MAPT (0.35) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL21394018 0.93 MAPT (0.35) MAPTMEN1KMT2AKDM4ELMNA

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-20210005822-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-01-07 US disclosed