SCHEMBL17989695

SCHEMBL17989695

CC1(C)c2c(ccc3ccccc23)-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ AKR1C4 P17516 1/20 0.32
▸ AKR1C3 P42330 1/20 0.32
▸ AKR1C2 P52895 1/20 0.32
▸ AKR1C1 Q04828 1/20 0.32
▸ NTSR1 P30989 2/20 0.32
▸ PTGES O14684 2/20 0.31
▸ RORC P51449 1/20 0.31
▸ EDNRA P25101 1/20 0.31
▸ PDE6D O43924 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 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
SCHEMBL17989623 0.94 KDM4E (0.32) KDM4EATML3MBTL1NTSR1MEN1
SCHEMBL17988899 0.90 KDM4E (0.44) KDM4EATML3MBTL1RORCMEN1
SCHEMBL19933757 0.88 L3MBTL1 (0.45) HDAC4KDM4EATML3MBTL1PTGES
SCHEMBL17989686 0.87 KDM4E (0.31) HDAC4KDM4EATML3MBTL1
SCHEMBL17989694 0.87 KDM4E (0.31) HDAC4KDM4EATML3MBTL1
SCHEMBL17989689 0.87 KDM4E (0.33) HDAC4KDM4EATML3MBTL1
SCHEMBL24519148 0.87 KDM4E (0.34) HDAC4KDM4EATML3MBTL1PTGES
SCHEMBL19933755 0.86 L3MBTL1 (0.41) HDAC4KDM4EATML3MBTL1PTGES
SCHEMBL17245791 0.85 KDM4E (0.35) HDAC4KDM4EATML3MBTL1AKR1C4
SCHEMBL17989690 0.84 HDAC4 (0.35) HDAC4KDM4EATML3MBTL1AKR1C4

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
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