SCHEMBL6857249

SCHEMBL6857249

Cl[Zr](Cl)Oc1ccccc1C1=CC=CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.31

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
SCHEMBL7772691 0.77 PTGS2 (0.33) PTGS2
SCHEMBL3193300 0.77 PTGS2 (0.33) PTGS2
Hydrochloric Acid SCHEMBL4494200 0.77 PTGS2 (0.37) PTGS2
Hydrochloric Acid SCHEMBL1982668 0.76 PTGS2 (0.33) PTGS2
Hydrochloric Acid SCHEMBL1617991 0.76 PTGS2 (0.33) PTGS2
SCHEMBL30626777 0.75
SCHEMBL28006187 0.75
SCHEMBL21044936 0.74
SCHEMBL8855825 0.69
SCHEMBL8855879 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6787617-B1 FORMING NARROW MOLECULAR WEIGHT HOMOPOLYMERS AS INTERMEDIATES TO BLOCK OR TERMINAL FUNCTIONALIZED POLYMERS; HAFNIUM OR ZIRCONIUM CYCLOPENTADIENYL FUNCTIONALIZED CATALYSTS WITH TRIPHENYLBORON AND TRIALKYLALUMINUM COMPOUNDS JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF THE AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2004-09-07 US disclosed