SCHEMBL9633779

SCHEMBL9633779

COc1cc(C(=O)NS(=O)(=O)c2ccccc2Br)ccc1Cc1cccc2ccc(CCCCC(=O)N(C)C)cc12

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.46
CYSLTR1 Q9Y271 2/20 0.46

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
SCHEMBL9634990 0.92
SCHEMBL9633723 0.90
SCHEMBL9633707 0.83 KMT2A (0.41)
SCHEMBL9634189 0.82 PLA2G4A (0.41)
SCHEMBL9633818 0.82 NQO2 (0.42)
SCHEMBL9633121 0.81 PLA2G4A (0.42)
SCHEMBL9377840 0.77
SCHEMBL9372314 0.76
SCHEMBL9633847 0.76 EPHX2 (0.47) CYSLTR1
SCHEMBL9372178 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337765-B1 ACYLSULFONAMIDE DERIVATIVES OF ALPHA-CARBOCYCLYLTOLUIC ACIDS USED AS LEUKOTRIENE ANTAGONISTS ICI AMERICAS INC. (US) 1992-10-14 EP disclosed
US-5095038-A Antiinflammatory, antiallergens ICI AMERICAS INC. (US) 1992-03-10 US disclosed
EP-0337765-A2 Acylsulfonamide derivatives of alpha-carbocyclyltoluic acids used as leukotriene antagonists ICI AMERICAS INC. (US) 1989-10-18 EP disclosed