SCHEMBL1715007

SCHEMBL1715007

CCCCc1cc(CON)on1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.48
NOS2 P35228 1/20 0.37
MAPK14 Q16539 1/20 0.34
HRH2 P25021 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TLR8 Q9NR97 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
AGXT P21549 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL5584337 0.95 PPARA (0.54) PPARANOS2MEN1KMT2AKCNH2
SCHEMBL1715078 0.90 PPARA (0.40) PPARANOS2MEN1KMT2AALDH1A1
SCHEMBL10141470 0.83 PPARA (0.48) PPARANOS2MAPK14HRH2HRH3
SCHEMBL1715716 0.82 RAB9A (0.39) PPARAMEN1KMT2AAGXTKCNH2
SCHEMBL25653948 0.81 PPARA (0.51) PPARANOS2MAPK14HRH2HRH3
SCHEMBL13991122 0.80 PPARA (0.54) PPARANOS2MAPK14KMT2AALDH1A1
SCHEMBL2094373 0.79 PPARA (0.57) PPARAKCNH2
SCHEMBL12231974 0.78 PPARA (0.44) PPARANOS2MAPK14
SCHEMBL2094371 0.78 PPARA (0.56) PPARAKCNH2
SCHEMBL9630698 0.77 PPARA (0.55) PPARANOS2MAPK14ALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US claimed
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US disclosed
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 EP disclosed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 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-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof F9, F12, HDAC9 PPARA 1123/4885NOS2 3126/4885MAPK14 4706/4885

“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.