SCHEMBL27610071

SCHEMBL27610071

O=[SH](=O)NCCc1ccc(S(=O)(=O)Nc2cccc3c(Cl)c[nH]c23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.65
CA2 P00918 4/20 0.65
CA12 O43570 3/20 0.65
CA9 Q16790 2/20 0.65
CA3 P07451 1/20 0.65
CA6 P23280 1/20 0.65
CA5A P35218 1/20 0.65
CA7 P43166 1/20 0.65
CRBN Q96SW2 1/20 0.65
CA14 Q9ULX7 1/20 0.65
CA5B Q9Y2D0 1/20 0.65
IMPDH2 P12268 1/20 0.42
HAT1 O14929 2/20 0.42
EP300 Q09472 2/20 0.42
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
NR3C2 P08235 1/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL27591982 0.87 CA1 (0.65) CA1CA2CA12CA9CA3
SCHEMBL3062262 0.85 CA1 (0.65) CA1CA2CA12CA9CA3
SCHEMBL3055967 0.85 CA1 (0.67) CA1CA2CA12CA9CA3
SCHEMBL27420173 0.84 CA1 (0.70) CA1CA2CA12CA9CA3
SCHEMBL3071867 0.84 CA1 (0.64) CA1CA2CA12CA9CA3
SCHEMBL12190471 0.83 CA1 (0.79) CA1CA2CA12CA9CA3
SCHEMBL3060876 0.83 CA1 (0.74) CA1CA2CA12CA9CA3
SCHEMBL3071958 0.83 CA1 (0.67) CA1CA2CA12CA9CA3
SCHEMBL24278029 0.80 CA1 (0.70) CA1CA2CA12CA9CA3
SCHEMBL3071891 0.80 CA1 (0.78) CA1CA2CA12CA9CA3

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
CN-1551766-A Lymphocytic activation inhibitor and remedial agent for autoimmune disease ������������ʽ���� 2004-12-01 CN disclosed