Perhexiline

Perhexiline

SCHEMBL145849

C1CCC(C(C[C@H]2CCCCN2)C2CCCCC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CPT1BCPT2MTOR

The experimentally established mechanism targets of Perhexiline. 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
CPT2 known ✓ P23786 1/20 1.00
CYP2D6 P10635 3/20 1.00
MEN1 O00255 2/20 1.00
LMNA P02545 2/20 1.00
TP53 P04637 2/20 1.00
KMT2A Q03164 2/20 1.00
SLC6A2 P23975 2/20 1.00
SLC6A4 P31645 2/20 1.00
SLC6A3 Q01959 2/20 1.00
ALDH1A1 P00352 1/20 1.00
CYP1A2 P05177 1/20 1.00
TSHR P16473 1/20 1.00
MLNR O43193 1/20 1.00
ABCB11 O95342 1/20 1.00
EGFR P00533 1/20 1.00
FYN P06241 1/20 1.00
CHRM2 P08172 1/20 1.00
CHRM4 P08173 1/20 1.00
HTR1A P08908 1/20 1.00
CHRM5 P08912 1/20 1.00

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
Perhexiline SCHEMBL13417497 1.00 CYP2D6 (1.00) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL15516137 1.00 CYP2D6 (1.00) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL114894 1.00 CYP2D6 (1.00) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL4831305 0.98 CYP2D6 (0.96) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL28885519 0.98 CYP2D6 (0.96) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL29089418 0.98 CYP2D6 (0.96) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL16237937 0.94 CYP2D6 (0.89) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL16237276 0.89 CYP2D6 (0.80) CYP2D6MEN1LMNATP53KMT2A
Perhexiline SCHEMBL11451421 0.89 LMNA (0.80) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL16237275 0.89 CYP2D6 (0.80) CYP2D6MEN1LMNATP53KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013182519-A1 COMBINATION OF LYSOSOMOTROPIC OR AUTOPHAGY MODULATING AGENTS AND A GSK-3 INHIBITOR FOR TREATMENT OF CANCER UNIVERSITAET BASEL (CH) 2013-12-12 WO claimed
EP-2655619-A1 AUTOPHAGY INDUCER AND INHIBITOR COMBINATION THERAPY FOR THE TREATMENT OF NEOPLASMS Genentech, Inc. (US) 2013-10-30 EP claimed
WO-2012087336-A1 AUTOPHAGY INDUCER AND INHIBITOR COMBINATION THERAPY FOR THE TREATMENT OF NEOPLASMS GENENTECH, INC. (US) 2012-06-28 WO claimed
WO-2012088254-A1 AUTOPHAGY INDUCER AND INHIBITOR COMBINATION THERAPY FOR THE TREATMENT OF NEOPLASMS GENENTECH, INC. (US) 2012-06-28 WO claimed
US-20110071767-A1 Hepatotoxicity Molecular Models OCIMUM BIOSOLUNTIONS, INC. (IN) 2011-03-24 US claimed
US-7868036-B2 Organic compounds NOVARTIS AG (CH) 2011-01-11 US claimed
WO-2009114729-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING LYSOSOMAL STORAGE DISEASES AND DISORDERS IRM LLC (BM) 2009-09-17 WO claimed
EP-1717226-B1 2,7-SUBSTITUTED 5-AMINO-4-HYDROXY-8-(1H-INDOL-5-YL)-OCTAN AMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION SPEEDEL EXPERIMENTA AG (CH) 2009-01-21 EP claimed
US-20080280895-A1 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension NOVARTIS AG (CH) 2008-11-13 US claimed
US-20080058320-A1 Organic Compounds NOVARTIS AG (CH) 2008-03-06 US claimed
WO-2005090305-A1 5-AMINO-4-HYDROXY-7-(1H-INDOLMETHYL)-8-METHYLNONAMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 WO claimed
WO-2005090304-A1 ORGANIC COMPOUNDS SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 WO claimed
EP-1507813-A1 FAT BINDING USING INTER-POLYMER COMPLEX OF GLUCOSAMINE AND POLYACRYLIC ACID Ranbaxy Laboratories Limited (IN) 2005-02-23 EP claimed
EP-1385501-A2 PROBUCOL MONOESTERS AND THEIR USE TO INCREASE PLASMA HDL CHOLESTEROL LEVELS AND IMPROVE HDL FUNCTIONALITY Atherogenics, Inc. (US) 2004-02-04 EP claimed
WO-2003097714-A1 FAT BINDING USING INTER-POLYMER COMPLEX OF GLUCOSAMINE AND POLYACRYLIC ACID RANBAXY LABORATORIES LIMITED (IN) 2003-11-27 WO claimed
US-20030162824-A1 Methods of treating or preventing a cardiovascular condition using a cyclooxygenase-1 inhibitor PHARMACIA CORPORATION 2003-08-28 US claimed
US-20030158097-A1 P-glycoprotein modifier-containing medicinal compositions to be delivered to the large intestine HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2003-08-21 US claimed
WO-2002087556-A9 PROBUCOL MONOESTERS AND THEIR USE TO INCREASE PLASMA HDL CHOLESTEROL LEVELS AND IMPROVE HDL FUNCTIONALITY ATHEROGENICS INC (US) 2003-03-20 WO claimed
EP-1260233-A1 P-GLYCOPROTEIN MODIFIER-CONTAINING MEDICINAL COMPOSITIONS TO BE DELIVERED TO THE LARGE INTESTINE HISAMITSU PHARMACEUTICAL CO. INC. (JP) 2002-11-27 EP claimed
WO-2002087556-A2 PROBUCOL MONOESTERS AND THEIR USE TO INCREASE PLASMA HDL CHOLESTEROL LEVELS AND IMPROVE HDL FUNCTIONALITY ATHEROGENICS, INC. (US) 2002-11-07 WO 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-20030162824-A1 Methods of treating or preventing a cardiovascular condition using a cyclooxygenase-1 inhibitor PTGS1, PTGIS, TNNT2 CPT2 253/4885CYP2D6 906/4885MEN1 3212/4885
US-20080280895-A1 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension REN, AGTR1, AGTR2 CPT2 1944/4885CYP2D6 159/4885MEN1 1485/4885
US-20080058320-A1 Organic Compounds REN, AGTR1, ADH1C CPT2 2824/4885CYP2D6 115/4885MEN1 1572/4885

“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.