SCHEMBL6852856

SCHEMBL6852856

O=C(O)CCc1cc(C(F)(F)F)c(Oc2ccc(O)c(S(=O)(=O)c3ccccc3)c2)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 8/20 0.49
THRB P10828 8/20 0.49
PCNA P12004 3/20 0.47
POLB P06746 2/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
FFAR4 Q5NUL3 5/20 0.39
FFAR1 O14842 6/20 0.39
SUCNR1 Q9BXA5 1/20 0.37

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
SCHEMBL6854434 0.92 THRA (0.48) THRATHRBPCNAPOLBMAPK1
SCHEMBL6855018 0.86 THRB (0.48) THRATHRBPCNAPOLBMAPK1
SCHEMBL6852972 0.84 THRB (0.60) THRATHRBPCNAPOLBMAPK1
SCHEMBL6849370 0.82 THRB (0.49) THRATHRBPCNAPOLBHIF1A
SCHEMBL6855029 0.81 GAA (0.45) THRATHRBPCNAPOLBGAA
SCHEMBL6849582 0.80 THRB (0.50) THRATHRBPOLBGAAGFER
SCHEMBL6849578 0.80 THRB (0.50) THRATHRBPOLBGAAGFER
SCHEMBL6853030 0.78 THRB (0.57) THRATHRBPCNAPOLBMAPK1
SCHEMBL6855048 0.78 THRB (0.57) THRATHRBPCNAPOLBMAPK1
SCHEMBL6849344 0.76 THRB (0.55) THRATHRB

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
US-6777442-B2 Diphenyl derivatives BAYER AKTIENGESELLSCHAFT (DE) 2004-08-17 US disclosed
US-20030105078-A1 Diphenyl derivatives BAYER AKTIENGESSELLSCHAFT (DE) 2003-06-05 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-20030105078-A1 Diphenyl derivatives DPP4, DPP3, DPM1 THRA 4665/4885THRB 4614/4885PCNA 2040/4885

“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.