SCHEMBL2033434

SCHEMBL2033434

C1=Cc2ccccc2ON1.CCCCCS(N)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.34
CA1 P00915 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL27938466 0.89 ESR1 (0.34) CA2
SCHEMBL28006158 0.75 BID (0.43)
SCHEMBL16824031 0.75
Alcohol SCHEMBL8699806 0.75 MAPT (0.30)
SCHEMBL16341187 0.74 MAPT (0.37)
SCHEMBL3662203 0.74 MAPT (0.37)
Formaldehyde SCHEMBL27671091 0.73 MAPT (0.33)
Methyl Alcohol SCHEMBL28243297 0.73 MAPT (0.33)
SCHEMBL3201327 0.73 MAPT (0.36)
SCHEMBL7679297 0.73 MAPT (0.36)

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
WO-2011073276-A1 BENZOXAZINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO disclosed
WO-2011073273-A1 BENZOXAZINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO disclosed