Atorvastatin

Atorvastatin

SCHEMBL6266705

CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O.CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HMGCR

The experimentally established mechanism targets of Atorvastatin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HMGCR known ✓ P04035 10/20 1.00
SLCO1B1 Q9Y6L6 4/20 1.00
ABCB11 O95342 3/20 1.00
HDAC1 Q13547 2/20 1.00
HDAC2 Q92769 2/20 1.00
HDAC6 Q9UBN7 2/20 1.00
NR1I2 O75469 1/20 1.00
RHOC P08134 1/20 1.00
CYP3A4 P08684 1/20 1.00
THRB P10828 1/20 1.00
NR1H4 Q96RI1 1/20 1.00
ABCG2 Q9UNQ0 1/20 1.00
ABCC3 O15438 2/20 0.87
ABCC4 O15439 2/20 0.87
SLCO1B3 Q9NPD5 2/20 0.87
PDE6D O43924 3/20 0.77
ABCB1 P08183 1/20 0.58
ABCC2 Q92887 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
SCHEMBL21637576 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL3056792 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL537781 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL4201645 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL13900412 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL465015 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL8257670 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL3831 1.00 HMGCR (1.00) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL3930191 0.99 HMGCR (0.98) HMGCRSLCO1B1ABCB11HDAC1HDAC2
Atorvastatin SCHEMBL7037657 0.99 HMGCR (0.98) HMGCRSLCO1B1ABCB11HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102716068-A Method for carrying therapeutic substances into cells MAGFORCE NANOTECHNOLOGIES AG 2012-10-10 CN claimed
CN-119587702-A Pharmaceutical composition capable of improving bioavailability of oral statin drugs and application thereof 强生化学制药厂股份有限公司 2025-03-11 CN disclosed
EP-3675838-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS Puretecch LYT, Inc. (US) 2020-07-08 EP disclosed
EP-3642261-A1 BLOCK-COPOLYMERS FOR THE DELIVERY OF ACTIVE AGENTS Julius-Maximilians-Universität Würzburg (DE) 2020-04-29 EP disclosed
WO-2019046491-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS ARIYA THERAPEUTICS, INC. (US) 2019-03-07 WO disclosed
WO-2018234329-A1 BLOCK-COPOLYMERS FOR THE DELIVERY OF ACTIVE AGENTS JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2018-12-27 WO disclosed
US-9649366-B2 Manufacturing and purification processes of Complex protein found in Fraction IV to make a separated Apo, Transferrin, and Alpha 1 Antitrypsin (A1AT) or a combined Transferrin/Apo/Human Albumin/A1AT and all new found proteins HOANG KIEU (US) 2017-05-16 US disclosed
WO-2016162886-A1 HCQS FOR PROPHYLAXIS AND TREATMENT OF STATIN INDUCED DIABETES IPCA LABORATORIES LIMITED (IN) 2016-10-13 WO disclosed
US-20140142284-A1 Manufacturing and Purification Processes of Complex Protein found in Fraction IV to make a separated Apo, Transferrin, and Alpha 1 Anti strepsin (A1AT) or A combined Transferrin/Apo/Human Albumin/A1AT and all new found proteins HOANG KIEU (US) 2014-05-22 US disclosed
US-20140140987-A1 Manufacturing and Purification Processes of Complex Protein found in Fraction IV to make a separated Apo, Transferrin, and Alpha 1 Anti strepsin (A1AT) or A combined Transferrin/Apo/Human Albumin/A1AT and all new found proteins HOANG KIEU (US) 2014-05-22 US disclosed
CN-102949535-A Chinese herbal preparation resistant to hyperlipidemia and atherosclerosis and preparation method of Chinese herbal preparation SUZHOU TONGLI MEDICAL TECHNOLOGY CO LTD 2013-03-06 CN disclosed
WO-2005097191-A2 COMBINATIONS COMPRISING (S)- AMLODIPINE AND A HMG-CoA REDUCTASE INHIBITOR OR CHOLESTEROL ABSORPOTION INHIBITOR OR BOTH, AND METHODS FOR REDUCING HYPERTENSION SEPRACOR INC. (US) 2005-10-20 WO disclosed
WO-2000069446-A1 COMBINATION THERAPY FOR TREATING HYPERCHOLESTEROLEMIA GELTEX PHARMACEUTICALS, INC. (US) 2000-11-23 WO disclosed
EP-0971744-A2 COMBINATION THERAPY EMPLOYING ILEAL BILE ACID TRANSPORT INHIBITING BENZOTHIEPINES AND HMG Co-A REDUCTASE INHIBITORS G.D. SEARLE & CO. (US) 2000-01-19 EP disclosed
WO-1998040375-A2 COMBINATION OF ILEAL BILE ACID TRANSPORT INHIBITING BENZOTHIEPINES AND HMG Co-A REDUCTASE INHIBITORS G.D. SEARLE & CO. (US) 1998-09-17 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 (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-20140140987-A1 Manufacturing and Purification Processes of Complex Protein found in Fraction IV to make a separated Apo, Transferrin, and Alpha 1 Anti strepsin (A1AT) or A combined Transferrin/Apo/Human Albumin/A1AT and all new found proteins SERPINC1, HBG1, APOB HMGCR 1471/4885SLCO1B1 4671/4885ABCB11 2675/4885

“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.