SCHEMBL9968239

SCHEMBL9968239

CC(C)(C)c1cnc2c(c1)c1ccccc1n2-c1ccc(C(C)(C)c2ccc(-n3c4ccccc4c4cc(C(C)(C)C)cnc43)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PPARA Q07869 2/20 0.35
PTGER4 P35408 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PGR P06401 1/20 0.34
RORA P35398 1/20 0.34
RORC P51449 1/20 0.34
RORB Q92753 1/20 0.34
KIF11 P52732 2/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
PMM2 O15305 1/20 0.32

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
SCHEMBL9968246 0.78 KDM4E (0.36) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL10100856 0.78 KDM4E (0.59) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL10039116 0.78 KDM4E (0.59) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL24029949 0.77 KDM4E (0.47) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL13589232 0.77 KDM4E (0.43) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL16230990 0.77 L3MBTL1 (0.53) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL13714521 0.77 L3MBTL1 (0.53) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL16674265 0.77 L3MBTL1 (0.53) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL12383141 0.76 CYP1A2 (0.38) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL10206300 0.76 KDM4E (0.58) PPARGKDM4EATML3MBTL1PPARA

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-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed