SCHEMBL4335889

SCHEMBL4335889

Cc1ccc(S(=O)(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.39
CA1 P00915 8/20 0.39
STAT3 P40763 1/20 0.37
GAA P10253 2/20 0.36
BCHE P06276 2/20 0.35
ACHE P22303 2/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
VDR P11473 1/20 0.35
CA12 O43570 1/20 0.34
CA3 P07451 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA5B Q9Y2D0 1/20 0.34

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
SCHEMBL23882170 0.88 STAT3 (0.39) CA2CA1STAT3GAABCHE
SCHEMBL2533175 0.87 GAA (0.41) CA2CA1STAT3GAABCHE
SCHEMBL19436459 0.87 GAA (0.43) CA2CA1STAT3GAABCHE
SCHEMBL30775482 0.86 USP2 (0.42) CA2CA1STAT3GAABCHE
SCHEMBL5365715 0.85 CA1 (0.39) CA2CA1STAT3GAABCHE
SCHEMBL5369470 0.85 CA1 (0.39) CA2CA1STAT3GAABCHE
SCHEMBL9293183 0.84 STAT3 (0.42) CA2CA1STAT3GAABCHE
SCHEMBL3343193 0.84 ALDH1A1 (0.39) CA2CA1STAT3GAABCHE
SCHEMBL6853749 0.83 ALDH1A1 (0.38) CA2CA1STAT3ALDH1A1CYP3A4
SCHEMBL6852562 0.83 ALDH1A1 (0.38) CA2CA1STAT3ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612166-B2 Fluorous capping reagents and methods for peptide purification TRUSTEES OF TUFTS COLLEGE (US) 2009-11-03 US disclosed
US-20080275216-A1 Fluorous Capping Reagents and Methods for Peptide Purification TRUSTEES OF TUFTS COLLEGE (US) 2008-11-06 US disclosed
WO-2005118527-A2 FLUOROUS CAPPING REAGENTS, AND METHODS FOR PEPTIDE PURIFICATION TRUSTEES OF TUFTS COLLEGE (US) 2005-12-15 WO 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-20080275216-A1 Fluorous Capping Reagents and Methods for Peptide Purification DNPEP, ANPEP, RNGTT CA2 1311/4885CA1 392/4885STAT3 3978/4885

“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.