SCHEMBL13036718

SCHEMBL13036718

O=S(O)C(F)(F)C(F)(F)Sc1ccc(Br)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.35
KCNK2 O95069 2/20 0.34
KCNK10 P57789 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL3988473 0.81 KCNK2 (0.33) KCNK2KCNK10SMN1; SMN2ALDH1A1LMNA
SCHEMBL1260200 0.74 CYP2A6 (0.38) TERTKCNK2KCNK10SMN1; SMN2CA1
SCHEMBL1230237 0.74 CYP2A6 (0.38) TERTKCNK2KCNK10SMN1; SMN2CA1
SCHEMBL13807425 0.73 TERT (0.30) TERT
SCHEMBL5015191 0.71 CA2 (0.38) TERTKCNK2KCNK10SMN1; SMN2CA1
SCHEMBL13036716 0.71 CA2 (0.38) TERTKCNK2KCNK10SMN1; SMN2CA1
SCHEMBL25118403 0.71 KDM4E (0.35) KCNK2KCNK10SMN1; SMN2CA1CA2
SCHEMBL16317228 0.70 KCNK2 (0.35) TERTKCNK2KCNK10SMN1; SMN2CA1
SCHEMBL28535824 0.69 ALDH1A1 (0.40) KCNK2KCNK10CA1CA2CA5A
SCHEMBL381447 0.69 ALDH1A1 (0.58) KCNK2KCNK10SMN1; SMN2CA1CA2

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-7829603-B2 Stable trifluorostyrene containing compounds grafted to base polymers, and their use as polymer electrolyte membranes E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-09 US disclosed
US-20080032184-A1 Stable Trifluorostyrene Containing Compounds, And Their Use In Polymer Electroyte Membranes U.S. DEPARTMENT OF ENERGY 2008-02-07 US disclosed
US-20070208092-A1 Stable Trifluorostyrene Containing Compounds Grafted To Base Polymers, And Their Use As Polymer Electrolyte Membranes U.S. DEPARTMENT OF ENERGY 2007-09-06 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-20080032184-A1 Stable Trifluorostyrene Containing Compounds, And Their Use In Polymer Electroyte Membranes NHERF1, AFF1, SLCO2A1 TERT 2405/4885KCNK2 196/4885KCNK10 270/4885

“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.