SCHEMBL15626487

SCHEMBL15626487

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4cnc(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)nc4)cc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PTGER4 P35408 1/20 0.32
▸ PDK2 Q15119 3/20 0.32
▸ TSPO P30536 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ PGR P06401 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
SCHEMBL15358330 0.97 KDM4E (0.35) KDM4EATML3MBTL1PTGER4PDK2
SCHEMBL15626482 0.96 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PDK2
SCHEMBL24490406 0.94 KDM4E (0.37) KDM4EATML3MBTL1PDK2PGR
SCHEMBL16659306 0.93 KDM4E (0.36) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL16659295 0.93 KDM4E (0.36) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL15626447 0.91 TSPO (0.32) PDK2TSPOHDAC4
SCHEMBL15626452 0.91 TSPO (0.32) PDK2TSPOHDAC4
SCHEMBL24490404 0.91 KDM4E (0.35) KDM4EATML3MBTL1PDK2
SCHEMBL19061254 0.90 KDM4E (0.45) KDM4EATML3MBTL1PTGER4PDK2
SCHEMBL14212268 0.89 KDM4E (0.44) KDM4EATML3MBTL1PTGER4PDK2

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
US-20140084271-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-03-27 — — US disclosed
US-20140084271-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-03-27 — — US disclosed
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