SCHEMBL7052055

SCHEMBL7052055

NC(=O)NNc1ccc(S(N)(=O)=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.71
CA5A P35218 1/20 0.71
CA1 P00915 13/20 0.67
GAA P10253 5/20 0.63
KMT2A Q03164 1/20 0.58
CA12 O43570 1/20 0.55
CA9 Q16790 1/20 0.55

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
SCHEMBL9130898 0.85 GAA (0.68) CA2CA5ACA1GAAKMT2A
SCHEMBL5075214 0.83 PEPD (0.52) CA2CA5ACA1GAAKMT2A
SCHEMBL11358253 0.83 CA2 (0.68) CA2CA5ACA1GAAKMT2A
SCHEMBL28616093 0.82 CA2 (0.67) CA2CA5ACA1GAAKMT2A
SCHEMBL28102126 0.81 CA2 (0.70) CA2CA5ACA1GAAKMT2A
SCHEMBL358576 0.80 CA1 (0.80) CA2CA1KMT2ACA12CA9
SCHEMBL9179118 0.77 PEPD (0.64) CA2CA5ACA1GAAKMT2A
SCHEMBL22001051 0.75 CA2 (0.68) CA2CA5ACA1GAAKMT2A
SCHEMBL27909270 0.74 CA2 (0.57) CA2CA5ACA1GAAKMT2A
SCHEMBL3294840 0.74 KIF11 (0.57) GAA

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
US-20030089472-A1 For oxidation of lignin-containing materials (wood pulp) CODEXIS, INC. 2003-05-15 US claimed
WO-2003023134-A1 LACCASE ACTIVITY ENHANCERS FOR PULP BLEACHING CODEXIS INC (US) 2003-03-20 WO claimed
CN-106070267-A A kind of Herbicidal combinations containing symetryne and application thereof 山东奥坤生物科技有限公司 2016-11-09 CN disclosed
US-20030089472-A1 For oxidation of lignin-containing materials (wood pulp) CODEXIS, INC. 2003-05-15 US disclosed
WO-2003023134-A1 LACCASE ACTIVITY ENHANCERS FOR PULP BLEACHING CODEXIS INC (US) 2003-03-20 WO disclosed