SCHEMBL17990901

SCHEMBL17990901

c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-n4c5ccccc5c5c6sc7ccccc7c6c6ccccc6c54)c3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TP53 P04637 1/20 0.34
ATM Q13315 2/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TNKS O95271 2/20 0.32
TNKS2 Q9H2K2 2/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE7A Q13946 1/20 0.31
PDE3A Q14432 1/20 0.31
HSD17B10 Q99714 1/20 0.31
FAAH O00519 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PKM P14618 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
SCHEMBL17990832 0.94 TNKS (0.33) MAPTRXFP1ATMKDM4EL3MBTL1
SCHEMBL22960418 0.92 MAPT (0.36) MAPTRXFP1TP53ATMKDM4E
SCHEMBL17990884 0.91 MAPT (0.35) MAPTRXFP1TP53ATMKDM4E
SCHEMBL17691729 0.91 L3MBTL1 (0.34) MAPTRXFP1TP53ATMKDM4E
SCHEMBL22960405 0.91 MAPT (0.37) MAPTRXFP1TP53ATMKDM4E
SCHEMBL23960976 0.88 MAPT (0.37) MAPTRXFP1TP53ATMKDM4E
SCHEMBL17427700 0.88 MAPT (0.34) MAPTRXFP1TP53ATMKDM4E
SCHEMBL19985938 0.87 MAPT (0.36) MAPTRXFP1TP53ATMKDM4E
SCHEMBL17427707 0.87 L3MBTL1 (0.37) MAPTRXFP1TP53ATMKDM4E
SCHEMBL17246638 0.87 KDM4E (0.40) MAPTRXFP1TP53ATMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed