SCHEMBL18706151

SCHEMBL18706151

c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9[nH]c%10ccccc%10c9c8)c7)c6c5)ccc43)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
AHR P35869 1/20 0.36
KIF11 P52732 4/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
PDE7A Q13946 2/20 0.35
PDE7B Q9NP56 2/20 0.35
TSPO P30536 1/20 0.34
HDAC4 P56524 1/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34

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
SCHEMBL22198494 0.95 KDM4E (0.46) KDM4EATML3MBTL1AHRKIF11
SCHEMBL22198485 0.94 KDM4E (0.41) KDM4EATML3MBTL1AHRKIF11
SCHEMBL15445600 0.94 KDM4E (0.45) KDM4EATML3MBTL1AHRKIF11
SCHEMBL31297109 0.94 KDM4E (0.44) KDM4EATML3MBTL1AHRKIF11
SCHEMBL263161 0.94 KDM4E (0.44) KDM4EATML3MBTL1AHRKIF11
SCHEMBL30124788 0.94 KDM4E (0.44) KDM4EATML3MBTL1AHRKIF11
SCHEMBL17234274 0.94 KDM4E (0.44) KDM4EATML3MBTL1AHRKIF11
SCHEMBL17948128 0.94 KDM4E (0.44) KDM4EATML3MBTL1AHRKIF11
SCHEMBL17760050 0.93 KDM4E (0.42) KDM4EATML3MBTL1AHRKIF11
SCHEMBL17759668 0.93 KDM4E (0.42) KDM4EATML3MBTL1AHRKIF11

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-20170098784-A1 MULTI-COMPONENT HOST MATERIAL AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2017-04-06 US disclosed
US-20170098784-A1 MULTI-COMPONENT HOST MATERIAL AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2017-04-06 US disclosed