SCHEMBL19789866

SCHEMBL19789866

CCCCC1CS(=O)(=O)c2ccc(F)cc2C(C)C1O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 15/20 0.42
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL19789613 0.68 HTR1D (0.38) SLC10A2CA1CA2
SCHEMBL19789811 0.67 SLC10A2 (0.46) SLC10A2
SCHEMBL13620066 0.67 SLC10A2 (0.46) SLC10A2
SCHEMBL19789664 0.66 SLC10A2 (0.40) SLC10A2CA1CA2
SCHEMBL19789694 0.66 ADRA1D (0.38) SLC10A2
SCHEMBL6221311 0.65 SLC10A2 (0.86) SLC10A2
SCHEMBL13620064 0.64 SLC10A2 (0.44) SLC10A2
SCHEMBL19490442 0.64 ADRA1D (0.45) SLC10A2CA1CA2
SCHEMBL8522885 0.64 SLC10A2 (0.45) SLC10A2
SCHEMBL17033295 0.64 CA1 (0.56) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2282991-B1 METHOD FOR THE PRODUCTION OF 1,4-BENZOTHIEPIN-1,1-DIOXIDE DERIVATIVES SANOFI AVENTIS DEUTSCHLAND (DE) 2018-01-24 EP disclosed