SCHEMBL513334

SCHEMBL513334

O=C1COCCN1Cc1ccccc1NS(=O)(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
PTGS1 P23219 4/20 0.38
PTGS2 P35354 4/20 0.38
PDK2 Q15119 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
RORC P51449 1/20 0.35
VCP P55072 1/20 0.35
GCK P35557 1/20 0.34
PER2 O15055 2/20 0.33
ALDH1A1 P00352 2/20 0.33
F10 P00742 1/20 0.33
AOC2 O75106 1/20 0.33
TRPC5 Q9UL62 1/20 0.33
NTRK1 P04629 1/20 0.33
LMNA P02545 1/20 0.32
CRY2 Q49AN0 1/20 0.32
CYP2A13 Q16696 1/20 0.32

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
SCHEMBL16389003 0.82 GCK (0.37) PTGS1PTGS2PDK2RORCGCK
SCHEMBL514430 0.81 CA2 (0.39) CA2PTGS1PTGS2VCP
SCHEMBL1964848 0.81 L3MBTL1 (0.47) CA2PTGS1PTGS2PER2ALDH1A1
SCHEMBL515027 0.79 CA2 (0.39) CA2PTGS1PTGS2ALDH1A1TRPC5
SCHEMBL2579885 0.79 GRIN1 (0.40) CA2PTGS1PTGS2PDK2PER2
SCHEMBL513997 0.79 PTGS1 (0.39) CA2PTGS1PTGS2VCP
SCHEMBL1966561 0.77 PTGS1 (0.39) CA2PTGS1PTGS2PER2TRPC5
SCHEMBL1964598 0.77 PTGS1 (0.39) CA2PTGS1PTGS2ALDH1A1TRPC5
SCHEMBL16389061 0.76 PTGS1 (0.33) PTGS1PTGS2AOC2NTRK1
SCHEMBL1967281 0.75 MAPT (0.54) CA2PTGS1PTGS2PER2ALDH1A1

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-2420493-A1 HALOALKYLSULFONANILIDE DERIVATIVE Nissan Chemical Industries, Ltd. (JP) 2012-02-22 EP disclosed
US-20120029187-A1 HALOALKYLSULFONANILIDE DERIVATIVE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-02-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120029187-A1 HALOALKYLSULFONANILIDE DERIVATIVE CBR3, CBR1, HDHD5 CA2 200/4885PTGS1 3479/4885PTGS2 4244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.