SCHEMBL7110636

SCHEMBL7110636

CC(C)(C)ON(C=O)C(Cc1ccc(OCCCCCOc2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.52

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
SCHEMBL6759717 0.79 ITGB3 (0.59) LTB4R
SCHEMBL6757526 0.78 LTB4R (0.62) LTB4R
SCHEMBL6921291 0.78 LTB4R (0.59) LTB4R
SCHEMBL7424094 0.77 ITGB3 (0.41)
Trifluoroacetic Acid SCHEMBL7692847 0.76 LTB4R (0.57) LTB4R
SCHEMBL8132625 0.76 LTB4R (0.52) LTB4R
SCHEMBL9308843 0.74 ITGB3 (0.58)
SCHEMBL28233244 0.74 CYP1A2 (0.41)
SCHEMBL6757470 0.74 LTB4R (0.53) LTB4R
SCHEMBL6760729 0.73 SUCNR1 (0.54) LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1347784-A2 SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION Bristol-Myers Squibb Pharma Company (US) 2003-10-01 EP disclosed
WO-2002036173-A2 SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-05-10 WO disclosed