SCHEMBL8889216

SCHEMBL8889216

O=S(=O)(Nc1ccc(O)c(C[C@@H]2COc3ccc(OCc4ccc5ccc(Cl)cc5n4)cc3[C@@H]2O)c1)C(F)(F)F

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 5/20 0.49
LTB4R Q15722 4/20 0.48
CYSLTR2 Q9NS75 4/20 0.44

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
SCHEMBL8889212 1.00 CYSLTR1 (0.49) CYSLTR1LTB4RCYSLTR2
SCHEMBL8899936 0.94 CYSLTR1 (0.49) CYSLTR1LTB4RCYSLTR2
SCHEMBL8899931 0.94 CYSLTR1 (0.49) CYSLTR1LTB4RCYSLTR2
SCHEMBL8890632 0.91 CYSLTR1 (0.60) CYSLTR1LTB4RCYSLTR2
SCHEMBL8898032 0.91 CYSLTR1 (0.60) CYSLTR1LTB4RCYSLTR2
SCHEMBL8889585 0.88 LTB4R (0.55) CYSLTR1LTB4RCYSLTR2
SCHEMBL8889593 0.88 LTB4R (0.55) CYSLTR1LTB4RCYSLTR2
SCHEMBL8888725 0.80 LTB4R (0.66) CYSLTR1LTB4RCYSLTR2
SCHEMBL8888733 0.80 LTB4R (0.66) CYSLTR1LTB4RCYSLTR2
SCHEMBL9220544 0.80 LTB4R (0.66) CYSLTR1LTB4RCYSLTR2

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 5 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
US-5641789-A INHIBITORS OF LEUKOTRIENES AND/OR BLOCKERS OF LEUKOTRIENE RECEPTORS; USEFUL IN PREVENTION OR TREATMENT OF ASTHMA, ARTHRITIS, PSORIASIS, ULCERS, MYOCARDIAL INFARCTION PFIZER INC. (US) 1997-06-24 US disclosed
EP-0665842-A1 SULFONAMIDE DERIVATIVES OF BENZENEFUSED HYDROXY SUBSTITUTED CYCLOALKYL AND HETEROCYCLIC RING COMPOUNDS PFIZER INC. (US) 1995-08-09 EP disclosed
WO-1994008996-A1 SULFONAMIDE DERIVATIVES OF BENZENEFUSED HYDROXY SUBSTITUTED CYCLOALKYL AND HETEROCYCLIC RING COMPOUNDS PFIZER INC. (US) 1994-04-28 WO disclosed