SCHEMBL27689290

SCHEMBL27689290

c1cc2cccc3c4cccc5cccc(c(c1)c23)c54.c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.62
HSD17B10 Q99714 11/20 0.62
CYP1A2 P05177 7/20 0.62
HPGD P15428 7/20 0.62
THRB P10828 1/20 0.62
ERBB2 P04626 1/20 0.60
FYN P06241 1/20 0.60
MAOA P21397 1/20 0.60
ACHE P22303 1/20 0.60
AHR P35869 1/20 0.60
TSHR P16473 6/20 0.50
HIF1A Q16665 4/20 0.50
CASP1 P29466 3/20 0.50
MAPK1 P28482 3/20 0.50
CASP7 P55210 2/20 0.50
TP53 P04637 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.48
CYP3A4 P08684 3/20 0.45
CYP1B1 Q16678 2/20 0.45
CYP1A1 P04798 1/20 0.45

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
Benz(B)Anthracene SCHEMBL4978195 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Anthracene SCHEMBL5478607 0.97 ALDH1A1 (0.65) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL587397 0.87 CYP1A2 (0.65) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Benzo[E]Pyrene SCHEMBL28073387 0.87 ALDH1A1 (0.76) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4845145 0.87 ALDH1A1 (0.68) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Benzo[E]Pyrene SCHEMBL712530 0.86 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4979307 0.86 ALDH1A1 (0.57) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4851988 0.85 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Triphenylene SCHEMBL5501206 0.85 ALDH1A1 (0.82) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Naphthalene SCHEMBL87628 0.85 ALDH1A1 (0.72) ALDH1A1HSD17B10CYP1A2HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101114701-B Organic electroluminescent device UNIV TSINGHUA 2012-03-14 CN claimed
CN-101496114-B Voltage switchable dielectric material with conductive or semiconductive organic material SHOCKING TECHNOLOGIES INC 2012-11-28 CN disclosed
CN-102709485-A OELD (Organic Electroluminescent Device) and preparation method thereof KUNSHAN VISIONOX DISPLAY TECH 2012-10-03 CN disclosed
CN-102675032-A 2,7-bis-anthracene naphthalene compound, light emitting layer material, organic electroluminescent element, display device and lighting device CHISSO CORP 2012-09-19 CN disclosed
CN-102639591-A Dithienobenzo-thieno[3,2-b]thiophene-copolymer and its use as high performance solution processable semiconducting polymer BASF SE 2012-08-15 CN disclosed
CN-102598344-A Organic electroluminescent element NIPPON STEEL CHEMICAL CO 2012-07-18 CN disclosed
CN-102487125-A Dielectric composition XEROX CORP 2012-06-06 CN disclosed
CN-101369635-B Inverted OLED display device and preparation method thereof UNIV TSINGHUA 2012-05-30 CN disclosed
CN-102456710-A OLED (organic light-emitting diode) and manufacturing method thereof, perspective unidirectional light-emitting screen body and touch screen KUNSHAN VISIONOX DISPLAY TECH 2012-05-16 CN disclosed
CN-101989646-B Flexible passive organic electroluminescent device and production method thereof KUNSHAN VISIONOX DISPLAY TECH 2012-05-16 CN disclosed
CN-102459398-A Fused bithiophene-vinylene polymers BASF SE 2012-05-16 CN disclosed
CN-102442939-A Electronic transmission material with pyridylphenyl substituted anthracene compound, organic electroluminescence element, display device and illuminating device JNC CORP 2012-05-09 CN disclosed
CN-102378750-A Light-emitting element material precursor and method for producing same TORAY INDUSTRIES 2012-03-14 CN disclosed
CN-101114701-B Organic electroluminescent device UNIV TSINGHUA 2012-03-14 CN disclosed
CN-102333608-A Comprise polycrystalline diamond complex and the application thereof that are substantially free of the tungsten carbide crystal grain that presents exaggerated grain growth through the cemented tungsten carbide substrate US SYNTHETIC CORP 2012-01-25 CN disclosed
CN-102317345-A SEMICONDUCTOR MATERIALS PREPARED FROM DITHIENYLVINYLENE COPOLYMERS BASF SE 2012-01-11 CN disclosed
CN-101345292-B Top-illuminating OLED display device and preparation method thereof UNIV TSINGHUA 2012-01-04 CN disclosed
CN-100426556-C Single layer organic electro luminuous device UNIV TSINGHUA (CN) 2008-10-15 CN disclosed
CN-101080376-A Pyrene compound and light-emitting transistor element using same PIONEER CORP (JP) 2007-11-28 CN disclosed
CN-101072743-A Pyrene compound, and light-emitting transistor element and organic electroluminescent element using same PIONEER CORP (JP) 2007-11-14 CN disclosed