SCHEMBL14420170

SCHEMBL14420170

CCCc1cccc(CC(=O)OCOC(=O)CC)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
YWHAG P61981 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC7A5 Q01650 1/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40
PAM P19021 1/20 0.40
ALOX5 P09917 2/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
NLRP3 Q96P20 1/20 0.37
KAT6A Q92794 1/20 0.36

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
SCHEMBL14420220 0.91 PPARA (0.47) YWHAGALDH1A1PPARGPPARACYP4F2
SCHEMBL14420143 0.91 ALDH1A1 (0.53) YWHAGALDH1A1MAPK1L3MBTL1SLC7A5
SCHEMBL14420100 0.89 SLC7A5 (0.43) YWHAGALDH1A1MAPK1L3MBTL1SLC7A5
SCHEMBL2630609 0.87 PPARA (0.51) YWHAGALDH1A1MAPK1L3MBTL1SLC7A5
SCHEMBL14420094 0.87 MAPK1 (0.43) ALDH1A1MAPK1L3MBTL1SLC7A5PAM
SCHEMBL14420123 0.82 SLC7A5 (0.57) ALDH1A1SLC7A5CYP4F2CYP4A11NLRP3
SCHEMBL14420169 0.82 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1PPARGPPARA
SCHEMBL14420107 0.81 PPARA (0.46) YWHAGALDH1A1SLC7A5PPARGPPARA
SCHEMBL18331645 0.80 ALDH1A1 (0.63) ALDH1A1MAPK1L3MBTL1PAMALOX5
SCHEMBL14420160 0.78 ALDH1A1 (0.41) ALDH1A1MAPK1L3MBTL1SLC7A5PAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225303-A1 8-Oxoadenine Compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-09-27 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-20070225303-A1 8-Oxoadenine Compound TLR7, CCR8, TLR8 YWHAG 3139/4885ALDH1A1 1017/4885MAPK1 2737/4885

“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.