SCHEMBL16066090

SCHEMBL16066090

C1=Cc2c(cccc2-c2cccc(-c3ccc(N(c4ccc(-c5cccc(-c6ccccc6)c5)cc4)c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cc3)c2)CC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSPO P30536 1/20 0.33

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
SCHEMBL10207570 0.93 L3MBTL1 (0.39) KDM4EATML3MBTL1TSPO
SCHEMBL2604797 0.90 TSPO (0.36) KDM4EATML3MBTL1TSPO
SCHEMBL16985706 0.87 KDM4E (0.34) KDM4EATML3MBTL1
SCHEMBL4402283 0.86 MCL1 (0.31)
SCHEMBL15625897 0.83 TSPO (0.30) TSPO
SCHEMBL27349569 0.83 KDM4E (0.38) KDM4EATML3MBTL1TSPO
SCHEMBL12969798 0.83 KDM4E (0.35) KDM4EATML3MBTL1TSPO
SCHEMBL21239116 0.82 KDM4E (0.37) KDM4EATML3MBTL1TSPO
SCHEMBL24971733 0.82
SCHEMBL25700531 0.82 TSPO (0.31) KDM4EATML3MBTL1TSPO

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-2779263-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT DEVICE Mitsubishi Chemical Corporation (JP) 2014-09-17 EP disclosed