SCHEMBL4856685

SCHEMBL4856685

c1cc2cccc3c4cc5ccc6cccc7c8cccc9cc(c(c1)c23)c4c(c98)c5c67

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.58
HSD17B10 Q99714 8/20 0.58
HPGD P15428 6/20 0.58
CYP1A2 P05177 5/20 0.58
THRB P10828 1/20 0.58
FYN P06241 2/20 0.57
ACHE P22303 2/20 0.57
AHR P35869 2/20 0.57
ERBB2 P04626 1/20 0.57
MAOA P21397 1/20 0.57
TSHR P16473 6/20 0.43
CYP1B1 Q16678 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP1A1 P04798 2/20 0.43
HIF1A Q16665 3/20 0.41
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 2/20 0.38
CASP1 P29466 2/20 0.38
KMT2A Q03164 2/20 0.38

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
SCHEMBL4854068 0.93 CYP1A2 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5476035 0.93 CYP1A2 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5473829 0.93 CYP1A2 (0.59) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4851816 0.92 CYP1A2 (0.60) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4852069 0.91 ALDH1A1 (0.67) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5466363 0.91 CYP1A2 (0.63) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4849479 0.91 CYP1A2 (0.63) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4765172 0.91 CYP1A2 (0.63) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4846756 0.91 CYP1A2 (0.63) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5466666 0.91 ALDH1A1 (0.56) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-7175922-B2 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY (US) 2007-02-13 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-20050106415-A1 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2005-05-19 US disclosed
WO-2005040303-A1 AGGREGATE ORGANIC LIGHT EMITTING DIODE DEVICES EASTMAN KODAK COMPANY (US) 2005-05-06 WO disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed