SCHEMBL4978670

SCHEMBL4978670

CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CCC(=O)N1CCOCC1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 4/20 0.78
HMGCR P04035 6/20 0.61
SLCO1B1 Q9Y6L6 4/20 0.61
ABCB11 O95342 3/20 0.61
HDAC1 Q13547 2/20 0.61
HDAC2 Q92769 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
NR1I2 O75469 1/20 0.61
RHOC P08134 1/20 0.61
CYP3A4 P08684 1/20 0.61
THRB P10828 1/20 0.61
NR1H4 Q96RI1 1/20 0.61
ABCG2 Q9UNQ0 1/20 0.61
ABCB1 P08183 1/20 0.60
ABCC2 Q92887 1/20 0.60
ABCC3 O15438 2/20 0.59
ABCC4 O15439 2/20 0.59
SLCO1B3 Q9NPD5 2/20 0.59

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
SCHEMBL14318916 0.87 PDE6D (0.69) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL5809213 0.86 PDE6D (0.68) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL5805228 0.84 HMGCR (0.67) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL9906 0.83 HMGCR (0.72) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL5804867 0.83 HMGCR (0.66) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL5150889 0.83 HMGCR (0.70) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL12073345 0.83 HMGCR (0.72) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL5809239 0.82 HMGCR (0.71) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL12192335 0.82 HMGCR (0.77) PDE6DHMGCRSLCO1B1ABCB11HDAC1
SCHEMBL916646 0.82 PDE6D (0.62) PDE6DHMGCRSLCO1B1ABCB11HDAC1

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7399773-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid and phenylamide WARNER-LAMBERT COMPANY (US) 2008-07-15 US disclosed
US-7399773-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid and phenylamide WARNER-LAMBERT COMPANY (US) 2008-07-15 US disclosed
US-7399773-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid and phenylamide WARNER-LAMBERT COMPANY (US) 2008-07-15 US disclosed
US-7371855-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY (US) 2008-05-13 US disclosed
US-7371855-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY (US) 2008-05-13 US disclosed
US-7371855-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY (US) 2008-05-13 US disclosed
US-7361771-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY (US) 2008-04-22 US disclosed
US-7361771-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY (US) 2008-04-22 US disclosed
US-7361771-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY (US) 2008-04-22 US disclosed
EP-1353917-B1 NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-(2-((2R, 4R)-4-HYDROXY -6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL)-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE WARNER LAMBERT CO (US) 2007-03-28 EP disclosed
EP-1728785-A1 7-[(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-heptanoic acid ester 3,5-dioxo-acetal Warner-Lambert Company LLC (US) 2006-12-06 EP disclosed
EP-1724256-A2 Novel process for the synthesis of 5-(4-fluorphenyl)-1-2(2-((2r,4r)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl)-2-isopropyl-4-phenyl-1h-pyrrole-3-carboxylic acid phenylamide Warner-Lambert Company LLC (US) 2006-11-22 EP disclosed
US-20050239869-A1 Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1eta-pyrrole-3-carboxylic acid phenylamide BUTLER DONALD E 2005-10-27 US disclosed
US-6933393-B2 Process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide WARNER-LAMBERT COMPANY LLC (US) 2005-08-23 US disclosed
EP-1353917-A2 NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-(2-((2R, 4R)-4-HYDROXY -6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL)-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE WARNER-LAMBERT COMPANY (US) 2003-10-22 EP disclosed
US-20030195353-A1 Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo- tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide BUTLER DONALD EUGENE (US) 2003-10-16 US disclosed
US-6545153-B1 Anticholesterol agents; antilipemic agents WARNER-LAMBERT COMPANY 2003-04-08 US disclosed
US-6476235-B2 CHEMICAL INTERMEDIATE; ANTICHOLESTEROL AGENTS, ANTILIPEMIC AGENTS WARNER-LAMBERT COMPANY 2002-11-05 US disclosed
US-20020133026-A1 NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-[2-((2R,4R)-4-HYDROXY-6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE BUTLER DONALD EUGENE (US) 2002-09-19 US disclosed
WO-2002055519-A2 NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-[2-((2R, 4R)-4-HYDROXY -6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE WARNER LAMBERT CO (US) 2002-07-18 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 (3 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-20050239869-A1 Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1eta-pyrrole-3-carboxylic acid phenylamide PAH, PCCA, HPD PDE6D 859/4885HMGCR 1134/4885SLCO1B1 3816/4885
US-20030195353-A1 Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo- tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide PCCA, PAH, HPD PDE6D 1399/4885HMGCR 837/4885SLCO1B1 3776/4885
US-20020133026-A1 NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-[2-((2R,4R)-4-HYDROXY-6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE PCCA, PAH, HPD PDE6D 1406/4885HMGCR 995/4885SLCO1B1 3793/4885

“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.