SCHEMBL10138547

SCHEMBL10138547

C=Cc1cccc(-n2c3c(c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(C=C)c5)ccc42)C=CCC3)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL12116888 0.87 KDM4E (0.42) KDM4EATML3MBTL1
SCHEMBL14141236 0.87 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL5030607 0.87 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL16901103 0.86 ATM (0.38) KDM4EATML3MBTL1
SCHEMBL12018971 0.86 L3MBTL1 (0.45) KDM4EATML3MBTL1
SCHEMBL16853849 0.86 L3MBTL1 (0.45) KDM4EATML3MBTL1
SCHEMBL27447332 0.85 ATM (0.40) KDM4EATML3MBTL1
SCHEMBL25509504 0.85 ATM (0.40) KDM4EATML3MBTL1
SCHEMBL9975410 0.85 L3MBTL1 (0.42) KDM4EATML3MBTL1
SCHEMBL25073481 0.84 ATM (0.39) 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-2012003485-A2 HOLE TRANSPORT COMPOSITIONS AND RELATED DEVICES AND METHODS (I) PLEXTRONICS, INC. (US) 2012-01-05 — — WO disclosed
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