SCHEMBL5028223

SCHEMBL5028223

C1=CC(c2cccc(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c2)CC(n2c3ccccc3c3cc(-c4ccccc4)ccc32)=C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HDAC4 P56524 1/20 0.35
TSPO P30536 1/20 0.33
PTGER4 P35408 2/20 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
SCHEMBL21300839 0.96 KDM4E (0.36) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL26456567 0.91 HDAC4 (0.41) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL26178246 0.91 L3MBTL1 (0.41) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL20077874 0.90 HDAC4 (0.41) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL15030675 0.90 KDM4E (0.41) KDM4EATML3MBTL1HDAC4
SCHEMBL19452632 0.89 HDAC4 (0.35) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL27333558 0.89 KDM4E (0.36) KDM4EATML3MBTL1HDAC4
SCHEMBL23228071 0.83 TSPO (0.31) HDAC4TSPO
SCHEMBL21667200 0.83 HDAC4 (0.38) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL25117363 0.83

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
EP-2453496-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, NOVEL COMPOUND, LIGHTING DEVICE AND DISPLAY DEVICE Konica Minolta Holdings, Inc. (JP) 2012-05-16 EP disclosed