SCHEMBL4847304

SCHEMBL4847304

c1ccc2c(c1)ccc1cc3c(ccc4c3ccc3c5ccccc5ccc34)cc12

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.89
HSD17B10 Q99714 3/20 0.89
CYP1B1 Q16678 2/20 0.89
HIF1A Q16665 1/20 0.89
HPRT1 P00492 4/20 0.78
CYP2A6 P11509 1/20 0.67
TSHR P16473 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
CYP1A2 P05177 4/20 0.56
HPGD P15428 2/20 0.56
PAX8 Q06710 1/20 0.54
TRPM4 Q8TD43 1/20 0.54
ERBB2 P04626 1/20 0.54
FYN P06241 1/20 0.54
MAOA P21397 1/20 0.54
ACHE P22303 1/20 0.54
AHR P35869 1/20 0.54
MAPT P10636 2/20 0.52
CYP1A1 P04798 1/20 0.52
CYP2C9 P11712 1/20 0.48

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
SCHEMBL4852455 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4854598 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL3325002 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4854152 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4852029 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4853205 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4851892 0.95 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL5473391 0.95 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL5470723 0.95 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4847360 0.95 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1

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 6 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
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed