Pitavastatin

Pitavastatin

SCHEMBL2878610

O=C(O)C[C@@H](O)C[C@@H](O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1

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 Pitavastatin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR known ✓ P04035 5/20 0.85
PDE4D Q08499 3/20 1.00
NR4A2 P43354 2/20 1.00
NR1I2 O75469 2/20 1.00
RXRA P19793 3/20 0.85
CYP2C9 P11712 4/20 0.54
SIRT6 Q8N6T7 2/20 0.54
TBXA2R P21731 2/20 0.54
ADRA1A P35348 2/20 0.54
ABCC3 O15438 1/20 0.54
ABCB11 O95342 1/20 0.54
PGR P06401 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
CCKAR P32238 1/20 0.54
PTGS2 P35354 1/20 0.54
SLC10A1 Q14973 1/20 0.54
PRKAA2 P54646 1/20 0.53
ESR1 P03372 1/20 0.51
CHRM1 P11229 1/20 0.51
PDE4A P27815 1/20 0.51

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
Pitavastatin SCHEMBL1582325 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL6068297 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL2878734 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL13278896 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL6068293 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL1582328 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL13278902 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL13278898 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL2878736 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA
Pitavastatin SCHEMBL3369 1.00 PDE4D (1.00) PDE4DNR4A2NR1I2HMGCRRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539698-B1 METHOD FOR PRODUCING A 3,5-DIHYDROXY-6-HEPTENOATE NISSAN CHEMICAL IND LTD (JP) 2010-10-20 EP disclosed
US-7550596-B2 Method of producing ethyl (3R, 5S, 6E)-7-[2 cyclopropyl-4-(fluorophenyl) quinoline-3-yl]-3, 5-dihydroxy-6-heptenoate DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-06-23 US disclosed
US-7339062-B2 Method for producing a 3,5-dihydroxy-6-heptenoate NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-03-04 US disclosed
US-20060167260-A1 Method for producing a 3,5-dihydroxy-6-heptenoate NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2006-07-27 US disclosed
US-20060089381-A1 Method of producing Ethyl (3R, 5S, 6E)-7-[2 cyclopropyl-4-(fluorophenyl) quinoline-3-yl]-3, 5-dihydroxy-6-heptenoate DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2006-04-27 US disclosed
US-5369109-A Optically active esters of 7-substituted 3,5-difunctionalized 6-heptenoic acids SAGAMI CHEMICAL RESEARCH CENTER (JP) 1994-11-29 US disclosed
EP-0475627-B1 Optically active esters of 7-substituted 3,5-difunctionalized 6-heptenoic acids SAGAMI CHEM RES (JP) 1994-10-19 EP disclosed
US-5276154-A Optically active esters of 7-substituted 3,5-difunctionalized 6-heptenoic acids SAGAMI CHEMICAL RESEARCH CENTER (JP) 1994-01-04 US disclosed
EP-0475627-A1 Optically active esters of 7-substituted 3,5-difunctionalized 6-heptenoic acids SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-03-18 EP 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-20060089381-A1 Method of producing Ethyl (3R, 5S, 6E)-7-[2 cyclopropyl-4-(fluorophenyl) quinoline-3-yl]-3, 5-dihydroxy-6-heptenoate UGT1A6, RPL6, CXCR6 HMGCR 634/4885PDE4D 666/4885NR4A2 3641/4885
US-20060167260-A1 Method for producing a 3,5-dihydroxy-6-heptenoate HMGCR, DHCR7, CYP46A1 HMGCR 1/4885PDE4D 1756/4885NR4A2 1603/4885

“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.