SCHEMBL5661816

SCHEMBL5661816

CCOC(=O)C(C)(C)Oc1ccc(OCc2ccc3cc(OS(C)(=O)=O)ccc3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 8/20 0.49
▸ ABCB11 O95342 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HTR2A P28223 1/20 0.49
▸ PMP22 Q01453 1/20 0.49
▸ FBP1 P09467 6/20 0.44
▸ PPARG P37231 7/20 0.42
▸ MAOB P27338 1/20 0.40
▸ PPARD Q03181 1/20 0.40
▸ OPRK1 P41145 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
SCHEMBL5661070 0.86 PPARG (0.57) PPARAPPARGPPARD
SCHEMBL5660104 0.84 PPARA (0.46) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL14584452 0.81 PPARA (0.56) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL5663196 0.80 PPARA (0.57) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL14584490 0.80 PPARG (0.52) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL14526727 0.80 PPARG (0.52) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL5660882 0.79 PPARA (0.50) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL5660596 0.78 PPARG (0.53) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL14526343 0.77 PPARA (0.48) PPARAPPARGMAOB
SCHEMBL14584501 0.77 FBP1 (0.56) PPARAABCB11CYP1A2CYP3A4TSHR

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-20070093476-A1 Novel compounds and their use in medicine,as antidiabetic and hypolipidemic agents, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-04-26 — — US claimed
US-20070093476-A1 Novel compounds and their use in medicine,as antidiabetic and hypolipidemic agents, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-04-26 — — US disclosed
US-20070093476-A1 Novel compounds and their use in medicine,as antidiabetic and hypolipidemic agents, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-04-26 — — US disclosed
US-20070093476-A1 Novel compounds and their use in medicine,as antidiabetic and hypolipidemic agents, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-04-26 — — 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-20070093476-A1 Novel compounds and their use in medicine,as antidiabetic and hypolipidemic agents, process for their preparation and pharmaceutical compositions containing them GPR119, NR1H3, NR1H2 PPARA 251/4885ABCB11 90/4885CYP1A2 1662/4885

“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.

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