Atorvastatin Lactone

Atorvastatin Lactone

SCHEMBL1265

CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CCC1CC(O)CC(=O)O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 1.00
SLCO1B1 Q9Y6L6 2/20 1.00
ABCB1 P08183 1/20 1.00
ABCC2 Q92887 1/20 1.00
NR1I2 O75469 1/20 0.58
ABCB11 O95342 1/20 0.58
RHOC P08134 1/20 0.58
CYP3A4 P08684 1/20 0.58
THRB P10828 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC2 Q92769 1/20 0.58
NR1H4 Q96RI1 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
ABCG2 Q9UNQ0 1/20 0.58

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
Atorvastatin Lactone SCHEMBL13762456 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB1ABCC2NR1I2
Atorvastatin Lactone SCHEMBL1258955 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB1ABCC2NR1I2
Atorvastatin Lactone SCHEMBL12648491 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB1ABCC2NR1I2
Atorvastatin Lactone SCHEMBL1266 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB1ABCC2NR1I2
Atorvastatin Lactone SCHEMBL10025147 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB1ABCC2NR1I2
Atorvastatin Lactone SCHEMBL12060138 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB1ABCC2NR1I2
Atorvastatin Lactone SCHEMBL9810905 0.97 HMGCR (0.94) HMGCRSLCO1B1ABCB1ABCC2NR1I2
SCHEMBL5605464 0.96 HMGCR (0.93) HMGCRSLCO1B1ABCB1ABCC2NR1I2
SCHEMBL13992376 0.96 HMGCR (0.93) HMGCRSLCO1B1ABCB1ABCC2NR1I2
SCHEMBL5605468 0.96 HMGCR (0.93) HMGCRSLCO1B1ABCB1ABCC2NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118476-A1 Process for Preparing Chiral Compounds PFIZER INC. 2011-05-19 US claimed
EP-2185713-A2 PROCESS FOR PREPARING CHIRAL COMPOUNDS Pfizer Products Inc. (US) 2010-05-19 EP claimed
US-RE40667-E1 [R-(R*R*)]-2-(4-fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid, its lactone form and salts thereof WARNER-LAMBERT COMPANY LLC (US) 2009-03-17 US claimed
WO-2009019561-A2 PROCESS FOR PREPARING CHIRAL COMPOUNDS PFIZER PRODUCTS INC. (US) 2009-02-12 WO claimed
EP-1411923-B1 PHARMACEUTICAL COMPOSITIONS OF AMLODIPINE AND ATORVASTATIN WARNER LAMBERT CO (US) 2008-02-13 EP claimed
EP-1852116-A1 Pharmaceutical compositions of amlodipine and atorvastatin Warner-Lambert Company LLC (US) 2007-11-07 EP claimed
US-20050107446-A1 Pharmaceutical compositions of amlodipine and atorvastatin ALANI LAMAN (US) 2005-05-19 US claimed
EP-1411923-A1 PHARMACEUTICAL COMPOSITIONS OF AMLODIPINE AND ATORVASTATIN Warner-Lambert Company LLC (US) 2004-04-28 EP claimed
US-20030114497-A1 Pharmaceutical compositions of amlodipine and atorvastatin ALANI LAMAN (US) 2003-06-19 US claimed
WO-2003011283-A1 PHARMACEUTICAL COMPOSITIONS OF AMLODIPINE AND ATORVASTATIN WARNER-LAMBERT COMPANY LLC (US) 2003-02-13 WO claimed
WO-1994020492-A1 NOVEL PROCESS FOR TRANS-6-[2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER-LAMBERT COMPANY (US) 1994-09-15 WO claimed
EP-0330172-B1 Improved process for trans-6-[2-(substituted-pyrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER LAMBERT CO (US) 1994-08-10 EP claimed
US-5273995-A [R-(R*R*)]-2-(4-fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl-3-phenyl-4-[(phenylamino) carbonyl]- 1H-pyrrole-1-heptanoic acid, its lactone form and salts thereof WARNER-LAMBERT COMPANY (US) 1993-12-28 US claimed
US-5216174-A Process for trans-6-[12-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT CO. (US) 1993-06-01 US claimed
EP-0448552-A1 IMPROVED PROCESS FOR $i(TRANS)-6- 2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER-LAMBERT COMPANY (US) 1991-10-02 EP claimed
US-5003080-A Process for trans-6-(2-(substituted-pyrrol-1-yl)alkyl)pryan-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1991-03-26 US claimed
EP-0247633-B1 Trans-6-[2-(3- or 4-Carboxamido-substituted pyrrol-1-yl)-alkyl]-4-hydroxypyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1991-01-30 EP claimed
EP-0330172-A2 Improved process for trans-6-[2-(substituted-pyrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1989-08-30 EP claimed
WO-1989007598-A2 IMPROVED PROCESS FOR TRANS-6-[2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER-LAMBERT COMPANY (US) 1989-08-24 WO claimed
US-4681893-A Trans-6-[2-(3- or 4-carboxamido-substituted pyrrol-1-yl)alkyl]-4-hydroxypyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1987-07-21 US claimed

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-20050107446-A1 Pharmaceutical compositions of amlodipine and atorvastatin HMGCR, PCSK9, APOB HMGCR 1/4885SLCO1B1 78/4885ABCB1 96/4885
US-20110118476-A1 Process for Preparing Chiral Compounds DERA, ALDOA, DPYD HMGCR 935/4885SLCO1B1 446/4885ABCB1 623/4885
US-20030114497-A1 Pharmaceutical compositions of amlodipine and atorvastatin HMGCR, PCSK9, APOB HMGCR 1/4885SLCO1B1 78/4885ABCB1 96/4885

“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.