SCHEMBL11031364

SCHEMBL11031364

[N-]=[N+]=NS(=O)(=O)c1ccc(-n2c(=O)n(-c3ccc(S(=O)(=O)N=[N+]=[N-])cc3)c(=O)n(-c3ccc(S(=O)(=O)N=[N+]=[N-])cc3)c2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
CA12 O43570 2/20 0.35
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
PKM P14618 1/20 0.30
BCL2L1 Q07817 1/20 0.30
BAK1 Q16611 1/20 0.30

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
SCHEMBL10823807 0.82 CA1 (0.43) CA1CA2CA9CA5ACA5B
SCHEMBL11797974 0.82 MAPT (0.33) CA1CA2CA9CA12PKM
SCHEMBL6917519 0.79 MGLL (0.50) PKM
SCHEMBL18173518 0.78 CA12 (0.56) CA1CA2CA9CA12
SCHEMBL5676376 0.77 CA2 (0.41) CA1CA2CA9CA12CA5A
SCHEMBL20111162 0.76 CA9 (0.58) CA1CA2CA9CA12
SCHEMBL18180096 0.76 CA2 (0.37) CA1CA2CA9CA12
SCHEMBL4126964 0.73 F2 (0.50) CA1CA2CA9CA12CA5A
SCHEMBL9645847 0.73 LMNA (0.46) CA1CA2CA9CA12CA5A
SCHEMBL11596619 0.73 F2 (0.50) CA1CA2CA9CA12CA5A

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-0019122-B1 PROCESS FOR THE PHOTOTECHNICAL PRODUCTION OF RELIEF STRUCTURES SIEMENS AKTIENGESELLSCHAFT (DE) 1985-07-31 EP disclosed