SCHEMBL3284607

SCHEMBL3284607

Cn1nc(NCCCCc2cccc(OC(C)(C)C(=O)OC(C)(C)C)c2)c(=O)n(CCCC(F)(F)F)c1=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.41
PPARG P37231 6/20 0.41
PPARD Q03181 2/20 0.36
KCNH2 Q12809 3/20 0.36
PCSK9 Q8NBP7 1/20 0.35
CYP2D6 P10635 2/20 0.34
SLC2A1 P11166 1/20 0.33
TRPC5 Q9UL62 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
SCHEMBL3288356 0.92 PPARA (0.52) PPARAPPARGPPARDKCNH2
SCHEMBL3287502 0.91 PPARA (0.48) PPARAPPARGPPARDKCNH2PCSK9
SCHEMBL3287335 0.90 PPARA (0.46) PPARAPPARGPPARDKCNH2PCSK9
SCHEMBL3284840 0.89 PPARA (0.51) PPARAPPARGPPARDKCNH2
SCHEMBL3844300 0.89 PPARA (0.47) PPARAPPARGPPARDKCNH2PCSK9
SCHEMBL3287490 0.87 PPARA (0.49) PPARAPPARGKCNH2CYP2D6
SCHEMBL3843436 0.86 PPARA (0.46) PPARAPPARGPPARDKCNH2PCSK9
SCHEMBL3285356 0.85 PPARA (0.51) PPARAPPARGPPARDKCNH2PCSK9
SCHEMBL3867966 0.85 PPARA (0.38) PPARAPPARGPPARDKCNH2PCSK9
SCHEMBL3844889 0.85 PPARA (0.42) PPARAPPARGPPARDKCNH2PCSK9

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.