SCHEMBL10242813

SCHEMBL10242813

COc1cc(F)c(C(C)C)cc1-c1ccc(C(F)(F)F)cc1CN1C(=O)O[C@H](c2cc(C)cc(C(F)(F)F)c2)[C@@H]1C

nearest known ligand 0.91

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.91
NR1I2 O75469 1/20 0.91

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
SCHEMBL17366580 1.00 CETP (0.91) CETPNR1I2
SCHEMBL10245315 0.95 CETP (0.94) CETPNR1I2
SCHEMBL15706605 0.95 CETP (0.94) CETPNR1I2
SCHEMBL17585956 0.95 CETP (0.94) CETPNR1I2
SCHEMBL17585942 0.95 CETP (0.91) CETPNR1I2
SCHEMBL15927667 0.95 CETP (0.91) CETPNR1I2
Anacetrapib SCHEMBL531448 0.95 CETP (1.00) CETPNR1I2
Anacetrapib SCHEMBL22281463 0.95 CETP (1.00) CETPNR1I2
Anacetrapib SCHEMBL18432840 0.95 CETP (1.00) CETPNR1I2
Anacetrapib SCHEMBL29807658 0.95 CETP (1.00) CETPNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8486983-B2 Self-emulsifying formulations of CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2013-07-16 US disclosed
EP-2415759-A1 CETP inhibitors Merck Sharp & Dohme Corporation (US) 2012-02-08 EP disclosed
US-8030359-B2 Polymer formulations of CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2011-10-04 US disclosed
US-7863307-B2 Process for synthesizing a CETP inhibitor MERCK SHARP & DOHME LLC 2011-01-04 US disclosed
US-20100041724-A1 Process For Synthesizing A CETP Inhibitor MERCK SHARP & DOHME LLC 2010-02-18 US disclosed
US-7652049-B2 1-benzyl-4-[4'-fluoro-5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]imidazolidin-2-one; cholesteryl ester transfer protein inhibitor; raising HDL-cholesterol, reducing LDL-cholesterol; atherosclerosis; antiinflammatory agent; synergistic mixture with other active ingredients MERCK & CO., INC. (US) 2010-01-26 US disclosed
US-20090186926-A1 Self-Emulsifying Formulations of CETP Inhibitors MERCK SHARP & DOHME LLC 2009-07-23 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 (2 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-20090186926-A1 Self-Emulsifying Formulations of CETP Inhibitors CETP, LIPA, LIPC CETP 1/4885NR1I2 443/4885
US-20100041724-A1 Process For Synthesizing A CETP Inhibitor CETP, MTTP, CTDSP1 CETP 1/4885NR1I2 166/4885

“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.