SCHEMBL5250076

SCHEMBL5250076

O=C(O)COCC(F)(F)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CTH P32929 1/20 0.36
CBS P35520 1/20 0.36
THPO P40225 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
THRB P10828 1/20 0.35
FFAR4 Q5NUL3 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL5356441 0.87 BLM (0.33) TSHRCTHCBSTHPOSMN1; SMN2
SCHEMBL5346360 0.87 BLM (0.33) TSHRCTHCBSTHPOSMN1; SMN2
SCHEMBL18129218 0.82 THRB (0.41) TSHRCTHCBSTHPOSMN1; SMN2
SCHEMBL816275 0.82 ALDH1A1 (0.42) TSHRCTHCBSTHPOSMN1; SMN2
SCHEMBL19170055 0.79 LMNA (0.33) TSHR
SCHEMBL24414202 0.78 TSHR (0.37) TSHR
SCHEMBL14963629 0.76 TSHR (0.41) TSHRCTHCBSTHPOSMN1; SMN2
SCHEMBL14904387 0.75 PKM (0.33) TSHRCTHCBSTHPOSMN1; SMN2
SCHEMBL859268 0.74
SCHEMBL5246328 0.73 CES2 (0.40) TSHRCTHCBSTHPOSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7195752-B2 Surfactant compounds and uses thereof GLAXO GROUP LIMITED (GB) 2007-03-27 US claimed
EP-1486203-A2 Surfactant compounds and uses thereof GLAXO GROUP LIMITED (GB) 2004-12-15 EP claimed
US-20040234556-A1 Surfactant compounds and uses thereof GLAXO GROUP LIMITED (GB) 2004-11-25 US claimed
EP-1411896-A2 SURFACTANT COMPOUNDS AND USES THEREOF GLAXO GROUP LIMITED (GB) 2004-04-28 EP claimed
WO-2003013610-A2 SURFACTANT COMPOUNDS AND USES THEREOF GLAXO GROUP LIMITED (GB) 2003-02-20 WO claimed
EP-1486203-B1 Surfactant compounds and uses thereof GLAXO GROUP LTD (GB) 2007-09-19 EP disclosed
US-7195752-B2 Surfactant compounds and uses thereof GLAXO GROUP LIMITED (GB) 2007-03-27 US disclosed
EP-1411896-B1 SURFACTANT COMPOUNDS AND USES THEREOF GLAXO GROUP LTD (GB) 2006-03-22 EP disclosed
EP-1486203-A2 Surfactant compounds and uses thereof GLAXO GROUP LIMITED (GB) 2004-12-15 EP disclosed
US-20040234556-A1 Surfactant compounds and uses thereof GLAXO GROUP LIMITED (GB) 2004-11-25 US disclosed
EP-1411896-A2 SURFACTANT COMPOUNDS AND USES THEREOF GLAXO GROUP LIMITED (GB) 2004-04-28 EP disclosed
WO-2003013610-A2 SURFACTANT COMPOUNDS AND USES THEREOF GLAXO GROUP LIMITED (GB) 2003-02-20 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-20040234556-A1 Surfactant compounds and uses thereof PFN1, SGMS1, SPTLC1 TSHR 3083/4885CTH 1922/4885CBS 2087/4885

“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.