SCHEMBL9048271

SCHEMBL9048271

COC1(c2cccc(Sc3ccc(N(C)S(C)(=O)=O)cc3)c2)CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 14/20 0.44
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL9047240 0.90 ALOX5 (0.42) ALOX5
SCHEMBL9045576 0.87 ALOX5 (0.39) ALOX5
SCHEMBL9464861 0.86 ALOX5 (0.39) ALOX5
SCHEMBL9210406 0.86 ALOX5 (0.43) ALOX5
SCHEMBL9046445 0.86 SLC6A2 (0.37) ALOX5SLC6A2SLC6A4SLC6A3
SCHEMBL9380927 0.83 ALOX5 (0.63) ALOX5
SCHEMBL9254837 0.83 ALOX5 (0.52) ALOX5
SCHEMBL9384495 0.81 ALOX5 (0.44) ALOX5
SCHEMBL9440429 0.81 ALOX5 (0.44) ALOX5
SCHEMBL9250493 0.81 ALOX5 (0.50) ALOX5

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-0495594-B1 Sulphonamide derivatives ZENECA LTD (GB) 1996-03-20 EP claimed
JP-5051374-A None JP disclosed
US-5258399-A 5-lipoxygenase inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-11-02 US disclosed
US-5236948-A Lipoxygenase inhibitor IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-17 US disclosed
JP-H0551374-A SULFONAMIDE DERIVATIVE, ITS MANUFACTURE AND MEDICINAL PREPARATION CONTAINING THE SAME USED FOR LEUKOTRIENE MEDIATION DISEASE OR MEDICAL SYMPTOM IMPERIAL CHEM IND PLC <ICI> 1993-03-02 JP disclosed