SCHEMBL2472773

SCHEMBL2472773

CCCCC(C(N)=O)c1ccc(S(N)(=O)=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 19/20 0.52
CA1 P00915 15/20 0.52
CA7 P43166 7/20 0.52
CA14 Q9ULX7 4/20 0.52
CA9 Q16790 6/20 0.51
CA4 P22748 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
CA12 O43570 4/20 0.48
TSHR P16473 1/20 0.47
CA5A P35218 1/20 0.44
CA5B Q9Y2D0 1/20 0.44

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
SCHEMBL2476366 0.94 CA2 (0.50) CA2CA1CA7CA14CA9
SCHEMBL27466843 0.84 CA2 (0.50) CA2CA1CA7CA14CA9
SCHEMBL675017 0.80 MMP9 (0.56) CA2CA1
SCHEMBL9395046 0.80 MMP9 (0.56) CA2CA1
SCHEMBL9450366 0.79 CA2 (0.56) CA2CA1CA7CA14CA9
SCHEMBL528414 0.79 EPHX1 (0.56) CA2CA1
SCHEMBL7027498 0.79 MMP3 (0.47) CA2CA1
Hydrochloric Acid SCHEMBL31092601 0.78 EPHX1 (0.54) CA2CA1
SCHEMBL27495544 0.77 MMP13 (0.53) CA2CA1
SCHEMBL6340363 0.77 TDP1 (0.43) TSHR

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-2373622-A2 CA-IX SPECIFIC RADIOPHARMACEUTICALS FOR THE TREATMENT AND IMAGING OF CANCER Molecular Insight Pharmaceuticals, Inc. (US) 2011-10-12 EP disclosed