SCHEMBL9955476

SCHEMBL9955476

COc1cc(F)c(C(C)C)cc1-c1ccc(C(F)(F)F)cc1CCl

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.62
NR1I2 O75469 1/20 0.56

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
SCHEMBL14016077 0.91 CETP (0.60) CETPNR1I2
SCHEMBL13395444 0.91 CETP (0.54) CETPNR1I2
SCHEMBL17546257 0.89 CETP (0.66) CETPNR1I2
SCHEMBL531553 0.89 CETP (0.63) CETPNR1I2
SCHEMBL20794179 0.89 CETP (0.63) CETPNR1I2
SCHEMBL9957610 0.88 CETP (0.62) CETPNR1I2
SCHEMBL531582 0.88 CETP (0.64) CETPNR1I2
SCHEMBL29786762 0.88 CETP (0.64) CETPNR1I2
SCHEMBL9955359 0.88 CETP (0.62) CETPNR1I2
SCHEMBL14016073 0.86 CETP (0.48) 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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2957342-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE ANTI-1,2-NITROALKANOL COMPOUND MICROBIAL CHEM RES FOUND (JP) 2020-07-29 EP disclosed
US-10300471-B2 Ruthenium-catalyzed synthesis of biaryl compounds in water CHICAGO DISCOVERY SOLUTIONS, LLC 2019-05-28 US disclosed
US-9901913-B2 Catalyst and method for producing optically active anti-1,2-nitroalkanol compound MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 2018-02-27 US disclosed
US-9901913-B2 Catalyst and method for producing optically active anti-1,2-nitroalkanol compound MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 2018-02-27 US disclosed
US-20160263565-A1 RUTHENIUM-CATALYZED SYNTHESIS OF BIARYL COMPOUNDS IN WATER CHICAGO DISCOVERY SOLUTIONS, LLC (US) 2016-09-15 US disclosed
EP-2985022-A1 PROCESS FOR SYNTHESIZING A CETP INHIBITOR Merck Sharp & Dohme Corp. (US) 2016-02-17 EP disclosed
US-20150375219-A1 Catalyst and Method for Producing Optically Active Anti-1,2-Nitroalkanol Compound Microbial Chemistry Rsearch Fiundation (JP) 2015-12-31 US disclosed
EP-2957342-A1 CATALYST AND METHOD FOR PRODUCING OPTICALLY ACTIVE ANTI-1,2-NITROALKANOL COMPOUND Microbial Chemistry Research Foundation (JP) 2015-12-23 EP disclosed
US-9212118-B2 Synthesis of intermediates for preparing anacetrapib and derivatives thereof LEK PHARMACEUTICALS D.D. (SI) 2015-12-15 US disclosed
US-9212118-B2 Synthesis of intermediates for preparing anacetrapib and derivatives thereof LEK PHARMACEUTICALS D.D. (SI) 2015-12-15 US disclosed
US-20100099716-A1 CETP INHIBITORS MERCK SHARP & DOHME LLC 2010-04-22 US disclosed
US-20100041724-A1 Process For Synthesizing A CETP Inhibitor MERCK SHARP & DOHME LLC 2010-02-18 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-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-20080119476-A1 Cetp Inhibitors ALI AMJAD 2008-05-22 US disclosed
US-20080119476-A1 Cetp Inhibitors ALI AMJAD 2008-05-22 US disclosed
WO-2007136672-A2 SYNTHESIS OF A BIARYL SYNTHETIC INTERMEDIATE MERCK & CO., INC. (US) 2007-11-29 WO disclosed
WO-2007092642-A2 POLYMER FORMULATIONS OF CETP INHIBITORS MERCK & CO., INC. (US) 2007-08-16 WO disclosed
WO-2007005572-A1 PROCESS FOR SYNTHESIZING A CETP INHIBITOR MERCK & CO., INC. (US) 2007-01-11 WO 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 (6 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-20150375219-A1 Catalyst and Method for Producing Optically Active Anti-1,2-Nitroalkanol Compound SCN1A, SCN1B, NOS1 CETP 4308/4885NR1I2 2580/4885
US-20080119476-A1 Cetp Inhibitors CETP, APOB, MTTP CETP 1/4885NR1I2 67/4885
US-10300471-B2 Ruthenium-catalyzed synthesis of biaryl compounds in water RUVBL2, RUVBL1, CYP2W1 CETP 4403/4885NR1I2 767/4885
US-20100041724-A1 Process For Synthesizing A CETP Inhibitor CETP, MTTP, CTDSP1 CETP 1/4885NR1I2 166/4885
US-20100099716-A1 CETP INHIBITORS CETP, APOB, MTTP CETP 1/4885NR1I2 67/4885
US-20160263565-A1 RUTHENIUM-CATALYZED SYNTHESIS OF BIARYL COMPOUNDS IN WATER RUVBL2, RUVBL1, CYP2W1 CETP 4403/4885NR1I2 767/4885

“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.