SCHEMBL8890111

SCHEMBL8890111

O=S(=O)(Nc1cccc(C[C@@H]2COc3ccc(OCc4nc(C5CCC5)cs4)cc3[C@@H]2O)c1)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 6/20 0.53
CYSLTR2 Q9NS75 4/20 0.53
LTB4R Q15722 5/20 0.41
LTB4R2 Q9NPC1 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
SCHEMBL8888590 1.00 CYSLTR1 (0.53) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8888586 1.00 CYSLTR1 (0.53) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8899267 0.88 CYSLTR1 (0.49) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8899272 0.88 CYSLTR1 (0.49) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8889217 0.87 CYSLTR1 (0.54) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8889221 0.87 CYSLTR1 (0.54) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8889214 0.87 CYSLTR1 (0.54) CYSLTR1CYSLTR2LTB4RLTB4R2
SCHEMBL8891759 0.87 CYSLTR1 (0.49) CYSLTR1CYSLTR2LTB4R
SCHEMBL8891753 0.87 CYSLTR1 (0.49) CYSLTR1CYSLTR2LTB4R
SCHEMBL8889669 0.84 CYSLTR1 (0.51) CYSLTR1CYSLTR2LTB4RLTB4R2

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