SCHEMBL3376154

SCHEMBL3376154

CCC1(C(=O)O)COc2ccc(Oc3ccc4c(-c5ccc(OC(F)(F)F)cc5)noc4c3)cc2O1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 10/20 0.39
▸ PPARG P37231 8/20 0.39
▸ PPARD Q03181 6/20 0.39
▸ IP6K1 Q92551 1/20 0.34
▸ IP6K3 Q96PC2 1/20 0.34
▸ IP6K2 Q9UHH9 1/20 0.34
▸ NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL3378319 1.00 PPARA (0.39) PPARAPPARGPPARDIP6K1IP6K3
SCHEMBL3379771 0.92 PPARD (0.39) PPARAPPARGPPARD
SCHEMBL3379726 0.92 PPARD (0.39) PPARAPPARGPPARD
SCHEMBL13069525 0.90 PPARD (0.35) PPARAPPARGPPARD
SCHEMBL13588382 0.90 PPARG (0.36) PPARAPPARG
SCHEMBL3376909 0.79 PPARD (0.53) PPARAPPARGPPARD
SCHEMBL3376978 0.79 PPARD (0.53) PPARAPPARGPPARD
SCHEMBL3379734 0.79 PPARD (0.37) PPARAPPARGPPARD
SCHEMBL3376972 0.79 PPARD (0.37) PPARAPPARGPPARD
SCHEMBL3376832 0.76 PPARA (0.53) PPARAPPARGPPARDIP6K1IP6K3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1796665-B1 COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK SHARP & DOHME (US) 2010-11-17 — — EP disclosed
US-7629372-B2 Compounds for the treatment of dyslipidemia and other lipid disorders MERCK & CO., INC. (US) 2009-12-08 — — US disclosed
US-20080039514-A1 Compounds for the Treatment of Dyslipidemia and Other Lipid Disorders MERCK & CO., INC. (US) 2008-02-14 — — 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-20080039514-A1 Compounds for the Treatment of Dyslipidemia and Other Lipid Disorders LIPA, APOB, LCAT PPARA 111/4885PPARG 152/4885PPARD 101/4885

“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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