SCHEMBL6853063

SCHEMBL6853063

O=Cc1cc(C(F)(F)F)c(Oc2ccc(O)c(S(=O)(=O)c3ccc(F)cc3)c2)c(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.35
THRB P10828 5/20 0.35
SOS1 Q07889 1/20 0.35
POLB P06746 2/20 0.34
HTR2A P28223 3/20 0.34
HTR2C P28335 3/20 0.34
KCNH2 Q12809 3/20 0.34
HSD11B1 P28845 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
GAA P10253 1/20 0.33
GFER P55789 1/20 0.33
CYP2D6 P10635 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
AR P10275 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 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
SCHEMBL6855029 0.90 GAA (0.45) THRATHRBPOLBHSD11B1ESR2
SCHEMBL6854934 0.88 THRB (0.48) THRATHRBESR1
SCHEMBL6854929 0.88 THRB (0.48) THRATHRBESR1
SCHEMBL6849370 0.82 THRB (0.49) THRATHRBPOLBHTR2AAR
SCHEMBL6854434 0.81 THRA (0.48) THRATHRBPOLBFFAR4
SCHEMBL6849578 0.79 THRB (0.50) THRATHRBPOLBESR1GAA
SCHEMBL6849582 0.79 THRB (0.50) THRATHRBPOLBESR1GAA
SCHEMBL6849344 0.76 THRB (0.55) THRATHRB
SCHEMBL6855018 0.75 THRB (0.48) THRATHRBPOLBFFAR4
SCHEMBL4961949 0.73 POLB (0.43) THRATHRBSOS1POLBHSD11B1

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 4614/4885SOS1 4540/4885

“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.