SCHEMBL20208933

SCHEMBL20208933

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c7c(cc54)Oc4ccccc4N7c4ccccc4O6)c3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL20208735 0.91 ATM (0.33) KDM4EATML3MBTL1
SCHEMBL20208630 0.90 P2RX4 (0.30)
SCHEMBL22812377 0.87 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL22812439 0.86 KDM4E (0.41) KDM4EATML3MBTL1
SCHEMBL20208980 0.86 WHR1 (0.33) ATM
SCHEMBL20208978 0.85
SCHEMBL22812390 0.84 TSPO (0.34) KDM4EATML3MBTL1
SCHEMBL20208801 0.84 HSD17B10 (0.38)
SCHEMBL20208702 0.83 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL20208707 0.83 KDM4E (0.37) KDM4EATML3MBTL1

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
EP-3544986-B1 BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-12-23 EP disclosed
WO-2018095839-A1 BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-05-31 WO disclosed