SCHEMBL22296476

SCHEMBL22296476

c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5c(-c6ccccc6)cccc54)c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.34
BACE1 P56817 1/20 0.34
KDM4E B2RXH2 4/20 0.33
TP53 P04637 2/20 0.33
ATM Q13315 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 3/20 0.32
LMNA P02545 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B10 Q99714 2/20 0.32
PDE10A Q9Y233 1/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL22296477 0.98 MAPT (0.33) MAPTBACE1KDM4ETP53ATM
SCHEMBL24362068 0.97 PDE10A (0.34) MAPTBACE1KDM4ETP53ATM
SCHEMBL16805681 0.96 BACE1 (0.36) MAPTBACE1KDM4ETP53ATM
SCHEMBL26725948 0.94 KDM4E (0.36) MAPTKDM4ETP53ATML3MBTL1
SCHEMBL25944390 0.94 PLA2G2A (0.33) MAPTBACE1KDM4ETP53ATM
SCHEMBL26851722 0.94 KDM4E (0.36) MAPTBACE1KDM4EATML3MBTL1
SCHEMBL24914965 0.94 KDM4E (0.36) MAPTKDM4ETP53ATML3MBTL1
SCHEMBL24490390 0.93 KDM4E (0.40) MAPTKDM4ETP53ATML3MBTL1
SCHEMBL21953222 0.93 KDM4E (0.40) MAPTKDM4ETP53ATML3MBTL1
SCHEMBL24216848 0.93 MAPT (0.34) MAPTBACE1KDM4ETP53ATM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022086171-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 WO disclosed
EP-3689867-B1 COMPOSITION, ORGANIC SEMICONDUCTOR LAYER AND ELECTRONIC DEVICE NOVALED GMBH (DE) 2021-12-15 EP disclosed
WO-2020157204-A1 COMPOSITION, ORGANIC SEMICONDUCTOR LAYER AND ELECTRONIC DEVICE NOVALED GMBH (DE) 2020-08-06 WO disclosed
EP-3689867-A1 COMPOSITION, ORGANIC SEMICONDUCTOR LAYER AND ELECTRONIC DEVICE Novaled GmbH (DE) 2020-08-05 EP disclosed