SCHEMBL20707565

SCHEMBL20707565

CC1CC=Cc2c1n(-c1ccc(-c3ccc4c(c3)c3cc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)ccc3n4-c3ccccc3)cc1)c1ccccc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HDAC4 P56524 1/20 0.35
▸ TSPO P30536 1/20 0.33
▸ PTGER4 P35408 1/20 0.32
▸ EDNRA P25101 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
SCHEMBL19570071 0.95 KDM4E (0.42) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL21155888 0.95 KDM4E (0.42) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL19570179 0.94 KDM4E (0.37) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL18568854 0.92 KDM4E (0.40) KDM4EATML3MBTL1HDAC4
SCHEMBL21845438 0.91 ATM (0.35) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL21388324 0.89 KDM4E (0.36) KDM4EATML3MBTL1HDAC4
SCHEMBL22185942 0.87 KDM4E (0.34) KDM4EATML3MBTL1HDAC4
SCHEMBL22134593 0.86 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL21300851 0.86 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL21673180 0.85 KDM4E (0.33) KDM4EATML3MBTL1PTGER4

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-3439062-A1 ORGANIC LIGHT EMITTING ELEMENT LG Chem, Ltd. (KR) 2019-02-06 — — EP disclosed
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