SCHEMBL3289554

SCHEMBL3289554

CCOC(=O)C(C)(C)Oc1cccc(CCCCNc2nn(CCC#N)c(=O)n(CCCC(F)(F)F)c2=O)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.46
PPARG P37231 5/20 0.46
PPARD Q03181 1/20 0.37
TLR7 Q9NYK1 8/20 0.35
GRM2 Q14416 1/20 0.35
KCNH2 Q12809 2/20 0.33
FBP1 P09467 1/20 0.33
PCSK9 Q8NBP7 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
SCHEMBL3285356 0.94 PPARA (0.51) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3285333 0.93 PPARA (0.52) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3286817 0.92 PPARA (0.56) PPARAPPARGPPARDTLR7
SCHEMBL3840924 0.92 PPARA (0.43) PPARAPPARGPPARDPCSK9
SCHEMBL3285389 0.92 PPARA (0.49) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3286847 0.90 PPARA (0.56) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3284207 0.90 PPARA (0.56) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3288356 0.89 PPARA (0.52) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3284140 0.89 PPARA (0.49) PPARAPPARGPPARDTLR7GRM2
SCHEMBL3287348 0.88 PPARA (0.54) PPARAPPARGPPARDTLR7GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713971-B2 1,2,4-triazine derivatives, preparation and use thereof in human therapy PIERRE FABRE MEDICAMENT (FR) 2010-05-11 US claimed
EP-1856065-B1 1,2,4-TRIAZINE DERIVATIVES, PREPARATION AND USE THEREOF IN HUMAN THERAPY PF MEDICAMENT (FR) 2009-11-11 EP claimed
US-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy PIERRE FABRE MEDICAMENT (FR) 2008-07-10 US claimed
US-7713971-B2 1,2,4-triazine derivatives, preparation and use thereof in human therapy PIERRE FABRE MEDICAMENT (FR) 2010-05-11 US disclosed
US-7713971-B2 1,2,4-triazine derivatives, preparation and use thereof in human therapy PIERRE FABRE MEDICAMENT (FR) 2010-05-11 US disclosed
US-7713971-B2 1,2,4-triazine derivatives, preparation and use thereof in human therapy PIERRE FABRE MEDICAMENT (FR) 2010-05-11 US disclosed
US-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy PIERRE FABRE MEDICAMENT (FR) 2008-07-10 US disclosed
US-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy PIERRE FABRE MEDICAMENT (FR) 2008-07-10 US disclosed
US-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy PIERRE FABRE MEDICAMENT (FR) 2008-07-10 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-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy CBR3, NOX3, RTN3 PPARA 3384/4885PPARG 2530/4885PPARD 2811/4885

“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.