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Sugi Predict / Compounds / SCHEMBL2365487

SCHEMBL2365487

SCHEMBL2365487

Cc1c(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(CCF)n1-c1ccc(F)cc1C(F)(F)F.Cc1c(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(CCO)n1-c1ccc(F)cc1C(F)(F)F

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NR3C2 P08235 7/20 0.67
▸ CA1 P00915 6/20 0.39
▸ CA2 P00918 6/20 0.39
▸ CA9 Q16790 6/20 0.39
▸ CA12 O43570 4/20 0.39
▸ CA7 P43166 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ CA5A P35218 1/20 0.37
▸ CA5B Q9Y2D0 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CHRNA7 P36544 1/20 0.36

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
SCHEMBL2545125 0.97 NR3C2 (0.70) NR3C2CA1CA2CA9CA12
SCHEMBL2548973 0.97 NR3C2 (0.61) NR3C2CA1CA2CA9CA12
SCHEMBL2365401 0.91 NR3C2 (0.81) NR3C2CA1CA2CA9CA12
SCHEMBL2359038 0.90 NR3C2 (0.82) NR3C2GAA
SCHEMBL2365488 0.89 NR3C2 (0.54) NR3C2CA1CA2CA9CA12
SCHEMBL2548930 0.88 NR3C2 (0.85) NR3C2CA1CA2CA9CA12
SCHEMBL2548305 0.87 NR3C2 (0.75) NR3C2CA1CA2CA9CA12
SCHEMBL1381638 0.85 NR3C2 (0.64) NR3C2CA1CA2CA9CA12
SCHEMBL2365402 0.81 NR3C2 (0.65) NR3C2CA1CA2CA9CA12
SCHEMBL2357173 0.80 NR3C2 (1.00) NR3C2GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349996-A1 1-PHENYLPYRROLE COMPOUNDS Exelixis, Inc. (US) 2011-08-03 — — EP disclosed
WO-2010042626-A1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS, INC. (US) 2010-04-15 — — WO disclosed