SCHEMBL3376972

SCHEMBL3376972

CC1(C(=O)O)COc2ccc(Oc3ccc4c(-c5ccc(C(F)(F)F)cc5)noc4c3)cc2O1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 8/20 0.37
▸ PPARA Q07869 6/20 0.37
▸ PPARG P37231 4/20 0.37
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ FFAR1 O14842 2/20 0.32
▸ PTPN1 P18031 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ FAAH O00519 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAP2K4 P45985 1/20 0.31

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
SCHEMBL3379734 1.00 PPARD (0.37) PPARDPPARAPPARGRAB9ANPC1
SCHEMBL3379726 0.87 PPARD (0.39) PPARDPPARAPPARGRAB9ANPC1
SCHEMBL3379771 0.87 PPARD (0.39) PPARDPPARAPPARGRAB9ANPC1
SCHEMBL13069525 0.81 PPARD (0.35) PPARDPPARAPPARG
SCHEMBL3378319 0.79 PPARA (0.39) PPARDPPARAPPARG
SCHEMBL3376978 0.78 PPARD (0.53) PPARDPPARAPPARG
SCHEMBL3377321 0.78 PPARA (0.52) PPARDPPARAPPARGRAB9ANPC1
SCHEMBL3376909 0.78 PPARD (0.53) PPARDPPARAPPARG
SCHEMBL3376890 0.78 PPARA (0.52) PPARDPPARAPPARGRAB9ANPC1
SCHEMBL13588382 0.77 PPARG (0.36) PPARAPPARGESR1ESR2MAPT

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 PPARD 101/4885PPARA 111/4885PPARG 152/4885

“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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