SCHEMBL3958199

SCHEMBL3958199

C=CC(F)C(Cc1ccccc1)C(=O)N1C(=O)OC[C@H]1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.42
IL6ST P40189 1/20 0.39
FAAH O00519 1/20 0.37
NAAA Q02083 1/20 0.36
IDH1 O75874 10/20 0.36
HDAC1 Q13547 2/20 0.34
AGTR2 P50052 1/20 0.34
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33

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
SCHEMBL3961014 1.00 PPARA (0.42) PPARAIL6STFAAHNAAAIDH1
SCHEMBL3959199 1.00 PPARA (0.42) PPARAIL6STFAAHNAAAIDH1
SCHEMBL3960159 0.86 IL6ST (0.49) PPARAIL6STFAAHNAAAIDH1
SCHEMBL3962683 0.86 IL6ST (0.49) PPARAIL6STFAAHNAAAIDH1
SCHEMBL3961873 0.85 PPARA (0.43) PPARAIL6STFAAHNAAAIDH1
SCHEMBL13719446 0.84 PPARA (0.48) PPARAIL6STFAAHNAAAIDH1
SCHEMBL24252139 0.83 PPARA (0.47) PPARAIL6STFAAHNAAAIDH1
SCHEMBL3967160 0.82 IL6ST (0.49) PPARAIL6STFAAHNAAAIDH1
SCHEMBL20536993 0.82 IL6ST (0.49) PPARAIL6STFAAHNAAAIDH1
SCHEMBL14690910 0.82 IL6ST (0.49) PPARAIL6STFAAHNAAAIDH1

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-7572928-B2 Fluorination process ISIS INNOVATION LIMITED (GB) 2009-08-11 US disclosed
US-20070142632-A1 Fluorination process ISIS INNOVATION LIMITED (GB) 2007-06-21 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-20070142632-A1 Fluorination process CYP2F1, SF3A2, SF3B2 PPARA 332/4885IL6ST 2604/4885FAAH 380/4885

“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.