SCHEMBL22296477

SCHEMBL22296477

c1ccc(-c2nc(-c3cccc(-c4cccc(-n5c6ccccc6c6c(-c7ccccc7)cccc65)c4)c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
BACE1 P56817 1/20 0.33
PDE10A Q9Y233 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
TP53 P04637 1/20 0.32
KDM4E B2RXH2 3/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 2/20 0.31
LMNA P02545 2/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL22296476 0.98 MAPT (0.34) MAPTBACE1PDE10ANPSR1TP53
SCHEMBL24362068 0.97 PDE10A (0.34) MAPTBACE1PDE10ANPSR1TP53
SCHEMBL25944390 0.94 PLA2G2A (0.33) MAPTBACE1PDE10ANPSR1TP53
SCHEMBL26851722 0.94 KDM4E (0.36) MAPTBACE1NPSR1KDM4EATM
SCHEMBL16805681 0.94 BACE1 (0.36) MAPTBACE1PDE10ANPSR1TP53
SCHEMBL24152777 0.94 KDM4E (0.38) MAPTPDE10ATP53KDM4EATM
SCHEMBL25132825 0.93 PDE10A (0.32) MAPTPDE10ATP53KDM4EATM
SCHEMBL26725948 0.92 KDM4E (0.36) MAPTPDE10ANPSR1TP53KDM4E
SCHEMBL22544363 0.92 PDE10A (0.33) MAPTPDE10ANPSR1TP53
SCHEMBL24352223 0.92 KDM4E (0.36) MAPTBACE1NPSR1TP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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