SCHEMBL4158540

SCHEMBL4158540

CCOC(=O)C(Cc1ccc(O)cc1)OCC(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.49
PPARA Q07869 7/20 0.49
ESR1 P03372 5/20 0.41
ESR2 Q92731 5/20 0.41
EPHX2 P34913 3/20 0.41
PTGS2 P35354 3/20 0.41
BACE1 P56817 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
PPARD Q03181 1/20 0.40
HDAC4 P56524 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL5994930 0.87 ESR1 (0.52) PPARGPPARAESR1ESR2PTGS2
SCHEMBL977514 0.85 PPARA (0.54) PPARGPPARAESR1ESR2PTGS2
SCHEMBL977513 0.85 PPARA (0.54) PPARGPPARAESR1ESR2PTGS2
SCHEMBL6419166 0.85 PPARA (0.54) PPARGPPARAESR1ESR2PTGS2
SCHEMBL5272161 0.82 PPARA (0.48) PPARGPPARAESR1ESR2PPARD
SCHEMBL4258664 0.81 PPARA (0.52) PPARGPPARAPPARD
SCHEMBL5379702 0.81 ESR1 (0.45) PPARGPPARAESR1ESR2PTGS2
SCHEMBL5379694 0.81 ESR1 (0.45) PPARGPPARAESR1ESR2PTGS2
SCHEMBL3991226 0.80 ESR1 (0.45) PPARAESR1ESR2PTGS2BACE1
SCHEMBL5384008 0.80 ESR1 (0.45) PPARAESR1ESR2PTGS2BACE1

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-20090124656-A1 Heterocyclic Oxime Compounds a Process for Their Preparation and Pharmaceutical Compositions Containing Them LES LABORATOIRES SERVIER (FR) 2009-05-14 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-20090124656-A1 Heterocyclic Oxime Compounds a Process for Their Preparation and Pharmaceutical Compositions Containing Them GPR119, HBB, CYP3A7 PPARG 969/4885PPARA 1020/4885ESR1 3058/4885

“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.