SCHEMBL15469020

SCHEMBL15469020

CC(C)(C)c1cc(-c2cc(F)cc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KIF11 P52732 1/20 0.34
PPARG P37231 4/20 0.33
PPARA Q07869 2/20 0.33
CYP11B2 P19099 5/20 0.32
KCNH2 Q12809 1/20 0.31
GPR3 P46089 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
CYP11B1 P15538 4/20 0.30
CYP19A1 P11511 3/20 0.30
CYP2C9 P11712 3/20 0.30
POLB P06746 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL22771507 0.91 ATM (0.44) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL10090523 0.91 KDM4E (0.47) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL10090537 0.86 ATM (0.52) ATMKDM4EL3MBTL1GPR3POLB
SCHEMBL12353925 0.85 KDM4E (0.46) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL12353923 0.84 L3MBTL1 (0.44) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL12353913 0.83 KDM4E (0.52) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL30846089 0.83 KDM4E (0.52) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL13232662 0.81 KIF11 (0.44) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL7600827 0.80 KDM4E (0.43) ATMKDM4EL3MBTL1KIF11PPARG
SCHEMBL13174316 0.80 ATM (0.48) ATMKDM4EL3MBTL1GPR3POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150129861-A1 ORGANIC MATERIAL FOR DEPOSITION, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, DEPOSITION METHOD, AND MANUFACTURING METHOD FOR ORGANIC PHOTOELECTRONIC ONVERSION ELEMENT OBTAINED USING THE SAME FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-20150129861-A1 ORGANIC MATERIAL FOR DEPOSITION, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, DEPOSITION METHOD, AND MANUFACTURING METHOD FOR ORGANIC PHOTOELECTRONIC ONVERSION ELEMENT OBTAINED USING THE SAME FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-20140042411-A1 METHOD FOR PURIFYING ORGANIC MATERIAL, MATERIAL FOR ORGANIC ELECTRONICS, PHOTOELECTRIC CONVERSION DEVICE, OPTICAL SENSOR, IMAGING DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2014-02-13 US disclosed