SCHEMBL9209735

SCHEMBL9209735

O=S(=O)(Nc1cccc(CC2COc3ccc(OCc4cc(F)c5ccccc5n4)cc3C2O)c1)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 5/20 0.52
CYSLTR1 Q9Y271 5/20 0.50
CYSLTR2 Q9NS75 4/20 0.50
LTB4R2 Q9NPC1 1/20 0.47

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
SCHEMBL9209729 1.00 LTB4R (0.52) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL9209746 1.00 LTB4R (0.52) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL9220544 0.89 LTB4R (0.66) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL8888725 0.89 LTB4R (0.66) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL8888733 0.89 LTB4R (0.66) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL8889481 0.86 LTB4R (0.55) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL9212064 0.86 LTB4R (0.55) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL8889488 0.86 LTB4R (0.55) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL8889593 0.84 LTB4R (0.55) LTB4RCYSLTR1CYSLTR2LTB4R2
SCHEMBL8889585 0.84 LTB4R (0.55) LTB4RCYSLTR1CYSLTR2LTB4R2

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-0665842-A1 SULFONAMIDE DERIVATIVES OF BENZENEFUSED HYDROXY SUBSTITUTED CYCLOALKYL AND HETEROCYCLIC RING COMPOUNDS PFIZER INC. (US) 1995-08-09 EP claimed
WO-1994008996-A1 SULFONAMIDE DERIVATIVES OF BENZENEFUSED HYDROXY SUBSTITUTED CYCLOALKYL AND HETEROCYCLIC RING COMPOUNDS PFIZER INC. (US) 1994-04-28 WO claimed