SCHEMBL17935005

SCHEMBL17935005

N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc(C#N)ccc4C#N)ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.39
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RORC P51449 7/20 0.37
USP14 P54578 3/20 0.35
PGR P06401 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ENPP3 O14638 1/20 0.33

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
SCHEMBL17934995 0.96 PTGER4 (0.37) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL17934861 0.95 KDM4E (0.44) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL17934865 0.95 KDM4E (0.44) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL17934963 0.94 KDM4E (0.41) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL17772250 0.94 PTGER4 (0.40) PTGER4KDM4ERORCALDH1A1ENPP3
SCHEMBL17934864 0.93 KDM4E (0.42) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL21116882 0.92 RORC (0.40) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL17934862 0.92 KDM4E (0.41) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL17935130 0.92 KDM4E (0.41) PTGER4KDM4EATML3MBTL1RORC
SCHEMBL22152890 0.92 KDM4E (0.36) PTGER4KDM4EATML3MBTL1RORC

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
US-20160211466-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-21 US disclosed