SCHEMBL4630262

SCHEMBL4630262

OCc1cc2ccccc2c2ccc3ccccc3c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
HSD17B10 Q99714 5/20 0.50
CYP1A2 P05177 4/20 0.50
HIF1A Q16665 3/20 0.50
CYP1B1 Q16678 2/20 0.50
FYN P06241 2/20 0.50
ACHE P22303 2/20 0.50
AHR P35869 2/20 0.50
ERBB2 P04626 1/20 0.50
MAOA P21397 1/20 0.50
HPRT1 P00492 3/20 0.48
TSHR P16473 3/20 0.46
CYP2A6 P11509 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HPGD P15428 4/20 0.44
MAPT P10636 2/20 0.44
MAPK1 P28482 2/20 0.41
CASP1 P29466 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP3A4 P08684 1/20 0.41

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
Sulfuric Acid SCHEMBL7994836 0.92 ERBB2 (0.43) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL2314306 0.87 CYP1A2 (0.46) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL18179348 0.86 TRPM4 (0.43) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL17183137 0.85 HSD17B10 (0.50) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL7794322 0.83 CYP1A2 (0.48) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL17183186 0.79 CYP1A2 (0.44) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL2313421 0.79 CYP1A2 (0.41) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL25368551 0.78 CYP1B1 (0.41) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL2310509 0.77 CYP1A2 (0.44) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1
SCHEMBL2310259 0.77 CYP1A2 (0.41) ALDH1A1HSD17B10CYP1A2HIF1ACYP1B1

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
EP-1766025-A4 PORCINE SULFOTRANSFERASE 2A1 POLYNUCLEOTIDE SEQUENCE, PROTEIN, AND METHODS OF USE FOR SAME UNIV GUELPH (CA) 2008-05-14 EP disclosed
EP-1766025-A1 PORCINE SULFOTRANSFERASE 2A1 POLYNUCLEOTIDE SEQUENCE, PROTEIN, AND METHODS OF USE FOR SAME UNIVERSITY OF GUELPH (CA) 2007-03-28 EP disclosed
US-20060024708-A1 Porcine sulfotransferase 2A1 polynucleotide sequence, protein, and methods of use for same UNIVERSITY OF GUELPH (CA) 2006-02-02 US disclosed
WO-2005123922-A1 PORCINE SULFOTRANSFERASE 2A1 POLYNUCLEOTIDE SEQUENCE, PROTEIN, AND METHODS OF USE FOR SAME UNIVERSITY OF GUELPH (CA) 2005-12-29 WO disclosed