SCHEMBL4855288

SCHEMBL4855288

c1ccc2cc3c(cc2c1)c1ccccc1c1c2ccc4ccccc4c2ccc31

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.67
ALDH1A1 P00352 5/20 0.61
HSD17B10 Q99714 5/20 0.61
HIF1A Q16665 3/20 0.61
CYP1B1 Q16678 1/20 0.61
TSHR P16473 3/20 0.57
CYP2A6 P11509 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
CYP1A2 P05177 4/20 0.54
HPGD P15428 3/20 0.54
THRB P10828 1/20 0.54
FYN P06241 2/20 0.54
ACHE P22303 2/20 0.54
AHR P35869 2/20 0.54
ERBB2 P04626 1/20 0.54
MAOA P21397 1/20 0.54
MAPT P10636 2/20 0.49
LCK P06239 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
SLC6A2 P23975 1/20 0.49

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
SCHEMBL4853775 0.95 HPRT1 (0.59) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL4848693 0.93 HPRT1 (0.56) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL4849139 0.91 HPRT1 (0.54) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL4853506 0.91 HSD17B10 (0.54) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL4853263 0.91 HPRT1 (0.67) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL3701854 0.90 HPRT1 (0.82) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL69097 0.90 HPRT1 (0.82) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL14976292 0.89 HPRT1 (0.52) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL4851956 0.89 ALDH1A1 (0.67) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL4853562 0.89 ALDH1A1 (0.67) HPRT1ALDH1A1HSD17B10HIF1ACYP1B1

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-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-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed