SCHEMBL20258147

SCHEMBL20258147

C1=CC(c2ccc3ccccc3c2)CC(n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)=C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
EGFR P00533 1/20 0.32
ERBB2 P04626 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
SCHEMBL15030675 0.82 KDM4E (0.41) KDM4EATML3MBTL1
SCHEMBL25930509 0.79 KDM4E (0.40) KDM4EATML3MBTL1
SCHEMBL20077874 0.78 HDAC4 (0.41) KDM4EATML3MBTL1
SCHEMBL5028223 0.78 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL26178246 0.77 L3MBTL1 (0.41) KDM4EATML3MBTL1
SCHEMBL26456567 0.77 HDAC4 (0.41) KDM4EATML3MBTL1
SCHEMBL21300839 0.76 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL21671366 0.75 KDM4E (0.50) KDM4EATML3MBTL1
SCHEMBL21671315 0.75 KDM4E (0.50) KDM4EATML3MBTL1
SCHEMBL10450016 0.75 KDM4E (0.50) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018105888-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2018-06-14 WO disclosed