SCHEMBL5660995

SCHEMBL5660995

CCOC(=O)C(C)(C)Oc1ccc(OCCCn2ccc3cc(OS(C)(=O)=O)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 8/20 0.47
▸ BCL2 P10415 4/20 0.46
▸ PPARG P37231 11/20 0.46
▸ PPARA Q07869 9/20 0.46
▸ PPARD Q03181 2/20 0.46
▸ ABCB11 O95342 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ PMP22 Q01453 1/20 0.42

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
SCHEMBL5661012 0.90 PPARA (0.42) MCL1BCL2PPARGPPARAPPARD
SCHEMBL5660099 0.89 PPARA (0.43) PPARGPPARAPPARDABCB11CYP1A2
SCHEMBL5659263 0.89 PPARG (0.54) MCL1BCL2PPARGPPARAPPARD
SCHEMBL5662960 0.88 MTNR1A (0.43) MCL1PPARGPPARAPPARDABCB11
SCHEMBL5661653 0.85 PPARG (0.55) MCL1BCL2PPARGPPARAPPARD
SCHEMBL14548303 0.82 MCL1 (0.47) MCL1BCL2PPARGPPARAPPARD
SCHEMBL5663196 0.81 PPARA (0.57) PPARGPPARAABCB11CYP1A2CYP3A4
SCHEMBL5660227 0.79 MCL1 (0.38) MCL1BCL2PPARGPPARAPPARD
SCHEMBL5660741 0.78 PPARG (0.49) MCL1BCL2PPARGPPARAPPARD
SCHEMBL5664183 0.78 PPARA (0.42) PPARGPPARAABCB11CYP1A2CYP3A4

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 MCL1 1367/4885BCL2 1802/4885PPARG 170/4885

“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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