SCHEMBL4532734

SCHEMBL4532734

COc1cc2/c(cc1OC)=c1/cc(OC)c(OC)c/c1=c1\cc(OC)c(OC)c\c1=c1/cc(OC)c(OC)c/c1=2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.53
MAPT P10636 2/20 0.53
CA2 P00918 4/20 0.48
CA9 Q16790 4/20 0.48
ALDH1A1 P00352 4/20 0.48
CA1 P00915 3/20 0.48
CA7 P43166 3/20 0.48
CA12 O43570 2/20 0.48
CA14 Q9ULX7 2/20 0.48
ACHE P22303 2/20 0.48
CA4 P22748 1/20 0.44
TSHR P16473 4/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL13518528 1.00 CYP3A4 (0.53) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL17164792 0.85 CA2 (0.55) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL1276533 0.84 CYP3A4 (0.59) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL29368836 0.77 CYP3A4 (0.53) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL11496731 0.77 ALDH1A1 (0.63) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL13518527 0.77 CYP3A4 (0.53) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL4532731 0.77 CYP3A4 (0.53) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL1711296 0.77 CYP3A4 (0.53) CYP3A4MAPTCA2CA9ALDH1A1
SCHEMBL7722083 0.74 CA2 (0.52) CYP3A4CA2CA9ALDH1A1CA1
SCHEMBL30302037 0.74 CYP3A4 (0.50) CYP3A4MAPTCA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8779138-B2 Camptothecin derivatives as chemoradiosensitizing agents Sutter West Bay Hospital (US) 2014-07-15 US disclosed
US-7633669-B2 Durable electrooptic devices comprising ionic liquids LOS ALAMOS NATIONAL SECURITY, LLC (US) 2009-12-15 US disclosed
US-7633669-B2 Durable electrooptic devices comprising ionic liquids LOS ALAMOS NATIONAL SECURITY, LLC (US) 2009-12-15 US disclosed
US-7633669-B2 Durable electrooptic devices comprising ionic liquids LOS ALAMOS NATIONAL SECURITY, LLC (US) 2009-12-15 US disclosed
US-20090103162-A1 Durable electrooptic devices comprising ionic liquids TRIAD NATIONAL SECURITY, LLC 2009-04-23 US disclosed
US-20090103162-A1 Durable electrooptic devices comprising ionic liquids TRIAD NATIONAL SECURITY, LLC 2009-04-23 US disclosed
US-20090103162-A1 Durable electrooptic devices comprising ionic liquids TRIAD NATIONAL SECURITY, LLC 2009-04-23 US disclosed
US-7450292-B1 for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors; electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation LOS ALAMOS NATIONAL SECURITY, LLC (US) 2008-11-11 US disclosed
US-7450292-B1 for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors; electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation LOS ALAMOS NATIONAL SECURITY, LLC (US) 2008-11-11 US disclosed
US-7450292-B1 for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors; electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation LOS ALAMOS NATIONAL SECURITY, LLC (US) 2008-11-11 US disclosed
US-20080266642-A1 DURABLE ELECTROOPTIC DEVICES COMPRISING IONIC LIQUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-10-30 US disclosed
US-20080266642-A1 DURABLE ELECTROOPTIC DEVICES COMPRISING IONIC LIQUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-10-30 US disclosed
US-20080266642-A1 DURABLE ELECTROOPTIC DEVICES COMPRISING IONIC LIQUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-10-30 US disclosed