SCHEMBL1925949

SCHEMBL1925949

Cc1cccc(S(N)(=O)=O)c1S(N)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.45
CA1 P00915 11/20 0.45
CA9 Q16790 10/20 0.45
CA4 P22748 4/20 0.45
CA7 P43166 4/20 0.45
CA12 O43570 4/20 0.45
CA6 P23280 3/20 0.45
CA5A P35218 3/20 0.45
CA5B Q9Y2D0 2/20 0.45
CYP2C9 P11712 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CDK2 P24941 1/20 0.44
MAPK1 P28482 1/20 0.40
STAT3 P40763 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL31311046 0.88 CA2 (0.42) CA2CA1CA9CA4CA7
SCHEMBL1954846 0.86 CA1 (0.45) CA2CA1CA9CA4CA7
SCHEMBL9819451 0.86 CA2 (0.41) CA2CA1CA9CA4CA7
SCHEMBL401308 0.80 CA2 (0.47) CA2CA1CA9CA4CA7
SCHEMBL31310995 0.80 CA2 (0.47) CA2CA1CA9CA4CA7
SCHEMBL11336938 0.80 GAA (0.60) CA2CA1CA9CA4CA7
SCHEMBL9768386 0.80 CA2 (0.50) CA2CA1CA9CA4CA7
SCHEMBL29410204 0.79 CA2 (0.56) CA2CA1CA9CA4CA7
SCHEMBL7369 0.79 CA2 (0.56) CA2CA1CA9CA4CA7
SCHEMBL11332578 0.79 HTR6 (0.51) CA2CA1CA9CA4CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922394-A 3 tetrazole radical benzene, 1,2 disulfonic acid amide derivative as metal beta lactamase restrainer 默沙东公司 2018-04-17 CN disclosed
US-7973089-B2 Membrane preparation method comprising the extrusion of a thermoplastic polymer bearing alkaline groupings INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) 2011-07-05 US disclosed
US-7956095-B2 Extrusion of a thermoplastic polymer bearing acid ionic groupings INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) 2011-06-07 US disclosed
US-20090203805-A1 Membrane Preparation Method Comprising the Extrusion of a Thermoplastic Polymer Bearing Alkaline Groupings INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE 2009-08-13 US disclosed
US-20090131544-A1 Extrusion of a Thermoplastic Polymer Bearing Acid Ionic Groupings SOCIETE SOLVAY SA (BE) 2009-05-21 US disclosed
US-5028456-A Unsaturated polyester, aromatic sulfonamide-aldehyde resin, repairing metal surfaces OATEY COMPANY (US) 1991-07-02 US disclosed
US-4980414-A CURABLE POLYESTER OATEY COMPANY (US) 1990-12-25 US disclosed