SCHEMBL10696321

SCHEMBL10696321

CCS(=O)(=O)c1cc(Br)c(N)c(Br)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.61
CA1 P00915 10/20 0.61
CA9 Q16790 9/20 0.61
CA3 P07451 1/20 0.61
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.42
PSIP1 O75475 2/20 0.41
CA12 O43570 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
APEX1 P27695 1/20 0.35
CYP2C19 P33261 1/20 0.35
GSK3B P49841 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
JAK2 O60674 1/20 0.35

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
SCHEMBL17200426 0.80 GAA (0.41) CA2CA1CA9CA3GAA
SCHEMBL4934516 0.80 PSIP1 (0.43) CA2CA1CA9CA3GAA
SCHEMBL11036178 0.80 CA2 (0.48) CA2CA1CA9CA3
SCHEMBL25247566 0.78 PSIP1 (0.41) CA2CA1CA9CA3GAA
SCHEMBL10688819 0.78 CA2 (0.66) CA2CA1CA9CA3GAA
SCHEMBL9350559 0.77 CA2 (0.67) CA2CA1CA9CA3GAA
SCHEMBL5981611 0.77 CA2 (0.73) CA2CA1CA9CA3GAA
SCHEMBL11136228 0.77 CA2 (1.00) CA2CA1CA9CA3GAA
SCHEMBL10694269 0.76 CA1 (0.53) CA2CA1CA9CA3CA12
SCHEMBL10695843 0.76 TSHR (0.54) CA2CA1CA9CA3LMNA

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
US-4754024-A Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups CIBA-GEIGY CORPORATION 1988-06-28 US disclosed