SCHEMBL10100816

SCHEMBL10100816

CC(C)(C)c1ccc(-n2c3ccccc3c3ccccc32)cc1-c1cc(-n2c3ccccc3c3ccccc32)ccc1C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GPR3 P46089 1/20 0.36
POLB P06746 1/20 0.35
PPARG P37231 4/20 0.33
KIF11 P52732 2/20 0.33
PPARA Q07869 2/20 0.32
PTPN1 P18031 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C19 P33261 2/20 0.31
TRPA1 O75762 1/20 0.31
ALDH1A1 P00352 3/20 0.31
HDAC4 P56524 1/20 0.31
GLA P06280 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL18771317 0.87 KDM4E (0.39) KDM4EATML3MBTL1GPR3PPARG
SCHEMBL7602348 0.85 KDM4E (0.41) KDM4EATML3MBTL1PPARGALDH1A1
SCHEMBL25137923 0.85 KDM4E (0.46) KDM4EATML3MBTL1GPR3POLB
SCHEMBL25490911 0.85 KDM4E (0.46) KDM4EATML3MBTL1GPR3POLB
SCHEMBL12811442 0.84 KDM4E (0.42) KDM4EATML3MBTL1GPR3POLB
SCHEMBL18771347 0.82 KDM4E (0.35) KDM4EATML3MBTL1POLBTRPA1
SCHEMBL21131611 0.81 KIF11 (0.40) KDM4EATML3MBTL1PPARGKIF11
SCHEMBL21131608 0.80 KIF11 (0.46) KDM4EATML3MBTL1PPARGKIF11
SCHEMBL21132070 0.80 KIF11 (0.46) KDM4EATML3MBTL1PPARGKIF11
SCHEMBL18771346 0.80 CA12 (0.36) KDM4EATML3MBTL1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178214-B2 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2012-05-15 US disclosed
US-8178214-B2 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2012-05-15 US disclosed
US-20070184301-A1 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-09 US disclosed
US-20070184301-A1 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-09 US disclosed