SCHEMBL8439741

SCHEMBL8439741

O=[N+]([O-])c1ccc(OC2O[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
SCHEMBL3138148 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805850-B1 NEW STRAIN OF KLEBSIELLA PNEUMONIAE, SUBSP. PNEUMONIAE AND PROCESS FOR PRODUCING A POLYSACCHARIDE CONTAINING L-FUCOSE BIOEUROPE (FR) 1999-12-15 EP disclosed
WO-1998017253-A1 METHOD AND COMPOSITIONS FOR DISRUPTING THE EPITHELIAL BARRIER FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-04-30 WO disclosed
EP-0805850-A1 NEW STRAIN OF KLEBSIELLA PNEUMONIAE, SUBSP. PNEUMONIAE AND PROCESS FOR PRODUCING A POLYSACCHARIDE CONTAINING L-FUCOSE BIOEUROPE (FR) 1997-11-12 EP disclosed
WO-1996023057-A1 NEW STRAIN OF KLEBSIELLA PNEUMONIAE, SUBSP. PNEUMONIAE AND PROCESS FOR PRODUCING A POLYSACCHARIDE CONTAINING L-FUCOSE BIOEUROPE (FR) 1996-08-01 WO disclosed
US-4275159-A IMMOBILIZATION PROJEKTIERUNG CHEMISCHE VERFAHRENSTECHNIK GMBH (DE) 1981-06-23 US disclosed
US-4200692-A Process for the production of xylose by enzymatic hydrolysis of xylan PROJEKTIERUNG CHEMISCHE VERFAHRENSTECHNIK GMBH (DE) 1980-04-29 US disclosed