SCHEMBL25958950

SCHEMBL25958950

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3c3ccccc3n4-c3ccc4c(c3)oc3cccc(-c5ccccc5)c34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.33
MAPT P10636 3/20 0.32
BACE1 P56817 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ATM Q13315 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPK14 Q16539 1/20 0.31

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
SCHEMBL21666805 1.00 PTGER4 (0.33) PTGER4MAPTBACE1KDM4EATM
SCHEMBL21671159 0.98 BACE1 (0.33) PTGER4MAPTBACE1KDM4EATM
SCHEMBL21671164 0.98 BACE1 (0.33) PTGER4MAPTBACE1KDM4EATM
SCHEMBL21667183 0.97 PTGER4 (0.32) PTGER4MAPTBACE1
SCHEMBL21666806 0.97 PTGER4 (0.34) PTGER4MAPTBACE1KDM4EATM
SCHEMBL24216686 0.96 PTGER4 (0.31) PTGER4MAPTBACE1KDM4EATM
SCHEMBL21898585 0.96 PTGER4 (0.33) PTGER4MAPTBACE1KDM4EATM
SCHEMBL21667054 0.93 KDM4E (0.36) PTGER4MAPTKDM4EATML3MBTL1
SCHEMBL21671183 0.93 ALDH1A1 (0.33) PTGER4MAPTBACE1KDM4EALDH1A1
SCHEMBL24217323 0.93 MAPT (0.34) PTGER4MAPTBACE1KDM4EL3MBTL1

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-2023149667-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-08-10 WO disclosed