SCHEMBL10693385

SCHEMBL10693385

CC(O)S(=O)(=O)c1ccc(N)c(Br)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.59
CA1 P00915 11/20 0.59
CA9 Q16790 9/20 0.59
CA12 O43570 6/20 0.59
CA4 P22748 4/20 0.59
CA6 P23280 4/20 0.59
CA5A P35218 4/20 0.59
CA7 P43166 4/20 0.59
CA14 Q9ULX7 4/20 0.59
CA5B Q9Y2D0 4/20 0.59
MAPT P10636 3/20 0.41
GAA P10253 2/20 0.41
PKM P14618 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
CA3 P07451 1/20 0.37
G6PD P11413 1/20 0.35
IDE P14735 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
SCHEMBL3369804 0.84 MAPT (0.53) CA2CA1CA9CA12CA4
SCHEMBL10914696 0.81 ALDH1A1 (0.46) CA2CA1CA9CA12CA4
SCHEMBL11280788 0.77 GAA (0.61) CA2CA1CA9CA12MAPT
SCHEMBL9501001 0.77 KDM4E (0.49) MAPTGAAPKMKDM4EMEN1
SCHEMBL3434572 0.76 CA2 (0.70) CA2CA1CA9CA12CA4
SCHEMBL29948313 0.76 CA2 (0.70) CA2CA1CA9CA12CA4
SCHEMBL10694524 0.76 CA2 (0.70) CA2CA1CA9CA12CA4
SCHEMBL2811342 0.75 CA2 (0.76) CA2CA1CA9CA12CA4
SCHEMBL30351262 0.75 CA2 (1.00) CA2CA1CA9CA12CA4
SCHEMBL878968 0.75 CA2 (1.00) CA2CA1CA9CA12CA4

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