SCHEMBL4850148

SCHEMBL4850148

c1cc2cccc3c4cc5c(cc4c(c1)c23)c1cccc2cccc5c21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.60
HSD17B10 Q99714 10/20 0.60
HPGD P15428 7/20 0.60
CYP1A2 P05177 6/20 0.60
THRB P10828 1/20 0.60
ERBB2 P04626 1/20 0.52
FYN P06241 1/20 0.52
MAOA P21397 1/20 0.52
ACHE P22303 1/20 0.52
AHR P35869 1/20 0.52
TSHR P16473 8/20 0.50
CYP3A4 P08684 4/20 0.50
CYP1B1 Q16678 2/20 0.50
CYP1A1 P04798 1/20 0.50
MAPK1 P28482 3/20 0.46
HIF1A Q16665 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
CASP1 P29466 2/20 0.46
TP53 P04637 1/20 0.42
CASP7 P55210 1/20 0.42

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
SCHEMBL3942736 0.94 ALDH1A1 (0.55) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL14673964 0.94 ALDH1A1 (0.55) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2152965 0.94 ALDH1A1 (0.55) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4979307 0.91 ALDH1A1 (0.57) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4851864 0.91 ALDH1A1 (0.74) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL634848 0.90 ALDH1A1 (0.71) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL6538859 0.90 ALDH1A1 (0.71) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL29906043 0.90 ALDH1A1 (0.71) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL26440 0.90 ALDH1A1 (0.71) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL21143411 0.87 ALDH1A1 (0.67) ALDH1A1HSD17B10HPGDCYP1A2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10168445-A None JP disclosed
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
US-20080074045-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-03-27 US disclosed
EP-1138745-B1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO (JP) 2007-03-28 EP disclosed
EP-1757670-A2 Organic electroluminescent element IDEMITSU KOSAN COMPANY LIMITED (JP) 2007-02-28 EP disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-20070003788-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2007-01-04 US disclosed
US-20060024523-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2006-02-02 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-6818327-B2 COLOR PURITY, EFFICIENCY IDEMITSU KOSAN CO., LTD. (JP) 2004-11-16 US disclosed
US-6815090-B1 ACENAPTHO(1,2-K)FLUORANTHENE DERIVATIVES; COLOR PURITY, EFFICIENT LIGHT EMISSION, DURABILITY IDEMITSU KOSAN CO., LTD. (JP) 2004-11-09 US disclosed
US-20040214043-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2004-10-28 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed
US-20030054200-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2003-03-20 US disclosed
EP-1138745-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN COMPANY LIMITED (JP) 2001-10-04 EP disclosed
JP-2000026325-A HYDROCARBON COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT MITSUI CHEMICALS INC 2000-01-25 JP disclosed
JP-H10168445-A ORGANIC ELECTROLUMINESCENT ELEMENT MITSUI CHEM INC 1998-06-23 JP disclosed