SCHEMBL3138148

SCHEMBL3138148

O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.63
CYP1A2 P05177 1/20 0.58
NFKB1 P19838 1/20 0.58
THPO P40225 1/20 0.58
ALDH1A1 P00352 1/20 0.58
PMP22 Q01453 1/20 0.58

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
SCHEMBL9149866 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL154485 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL4830684 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL4277097 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL3289586 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL79438 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL154484 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL10814176 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL344883 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1
SCHEMBL8439741 1.00 TYR (0.63) TYRCYP1A2NFKB1THPOALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6562606-B1 Composition for use as tool in the transfer pharmeceutical across epithelial barriers THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-05-13 US claimed
US-6190894-B1 APPLYING INHIBITORS OF BIOSYNTHESIS OR DEGRADATION, DEGRADATION ENZYMES, AND/OR INHIBITORS AND ACTIVATORS OF METABOLIC ENZYMES; FOR TOPICAL ADMINISTRATION OF PHYSIOLOGICALLY ACTIVE SUBSTANCES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-02-20 US claimed
WO-1998017253-A1 METHOD AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-04-30 WO claimed
EP-0764017-A4 METHODS AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION CELLEGY PHARMA INC (US) 1997-08-06 EP claimed
EP-0764017-A1 METHODS AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION CELLEGY PHARMACEUTICALS, INC. (US) 1997-03-26 EP claimed
WO-1994021230-A1 METHOD AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION CELLEGY PHARMACEUTICALS, INC. (US) 1994-09-29 WO claimed
US-9404136-B2 A-xylosidase enhanced conversion of plant biomass into fermentable sugars BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2016-08-02 US disclosed
US-20150337279-A1 RECOMBINANT FUNGAL POLYPEPTIDES SHELL OIL COMPANY 2015-11-26 US disclosed
US-20140004572-A1 A-XYLOSIDASE ENHANCED CONVERSION OF PLANT BIOMASS INTO FERMENTABLE SUGARS BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2014-01-02 US disclosed
US-8440449-B2 Transformed Saccharomyces cerevisiae engineered for xylose utilization THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2013-05-14 US disclosed
US-20100112658-A1 Transformed Saccharomyces cerevisiae Engineered for Xylose Utilization LIFESENSORS, INC. 2010-05-06 US disclosed
WO-2010039692-A2 TRANSFORMED SACCHAROMYCES CEREVISIAE ENGINEERED FOR XYLOSE UTILIZATION THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2010-04-08 WO disclosed
US-6562606-B1 Composition for use as tool in the transfer pharmeceutical across epithelial barriers THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-05-13 US disclosed
US-6190894-B1 APPLYING INHIBITORS OF BIOSYNTHESIS OR DEGRADATION, DEGRADATION ENZYMES, AND/OR INHIBITORS AND ACTIVATORS OF METABOLIC ENZYMES; FOR TOPICAL ADMINISTRATION OF PHYSIOLOGICALLY ACTIVE SUBSTANCES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-02-20 US disclosed
US-5824533-A GENETIC ENGINEERING, GENE EXPRESSION UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1998-10-20 US disclosed
EP-0764017-A4 METHODS AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION CELLEGY PHARMA INC (US) 1997-08-06 EP disclosed
EP-0764017-A1 METHODS AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION CELLEGY PHARMACEUTICALS, INC. (US) 1997-03-26 EP disclosed
WO-1994021230-A1 METHOD AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION CELLEGY PHARMACEUTICALS, INC. (US) 1994-09-29 WO disclosed