SCHEMBL27612875

SCHEMBL27612875

[CH2]C(C)NS(=O)(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
MMP1 P03956 1/20 0.55
MMP2 P08253 1/20 0.55
MMP9 P14780 1/20 0.55
MMP8 P22894 1/20 0.55
MMP13 P45452 1/20 0.55
NR3C1 P04150 16/20 0.51
NR3C2 P08235 13/20 0.51
PGR P06401 11/20 0.51
F2 P00734 1/20 0.46
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
GFER P55789 1/20 0.45

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
SCHEMBL5135614 0.84 CA1 (0.59) CA1CA2MMP1MMP2MMP9
SCHEMBL22808750 0.81 CA1 (0.55) CA1CA2MMP1MMP2MMP9
SCHEMBL5264423 0.79 NR3C1 (0.53) CA1CA2MMP1MMP2MMP9
SCHEMBL9189211 0.78 CA1 (0.52) CA1CA2MMP1MMP2MMP9
SCHEMBL6330641 0.77 NR3C1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL4119631 0.77 NR3C1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL5664360 0.77 MMP1 (0.55) CA1CA2MMP1MMP2MMP9
SCHEMBL5663653 0.77 MMP1 (0.55) CA1CA2MMP1MMP2MMP9
SCHEMBL4120059 0.77 NR3C1 (0.58) CA1CA2MMP1MMP2MMP9
SCHEMBL27721577 0.77 NR3C1 (0.58) CA1CA2MMP1MMP2MMP9

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-1678306-A -3 (sulfonamidoethyl) -indole derivaties for use as glucocorticoid mimetics in the treatment of inflammatory, allergic and proliferative diseases BOEHRINGER INGELHEIM PHARMA (US) 2005-10-05 CN disclosed