Cizolirtine

Cizolirtine

SCHEMBL1649170

CN(C)CCOC(c1ccccc1)c1ccnn1C.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACVR1ADORA1ADORA2AADORA2BADORA3ESR1ESR2FLT3GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSC1HRH1HTR7IDH1IDH2IRAK1JAK1JAK2JAK3MEN1OPRM1P2RX3PDE5ASCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASIGMAR1SLC6A2SYKTACR1TOP2ATYK2

The experimentally established mechanism targets of Cizolirtine. 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
SLC6A2 known ✓ P23975 4/20 0.48
OPRM1 known ✓ P35372 3/20 0.48
HRH1 known ✓ P35367 3/20 0.48
SCN1A known ✓ P35498 1/20 0.48
SCN5A known ✓ Q14524 1/20 0.48
SCN2A known ✓ Q99250 1/20 0.48
SCN3A known ✓ Q9NY46 1/20 0.48
MEN1 known ✓ O00255 1/20 0.43
ESR1 known ✓ P03372 1/20 0.43
ESR2 known ✓ Q92731 1/20 0.43
GRIN2D known ✓ O15399 1/20 0.42
GRIN3B known ✓ O60391 1/20 0.42
GRIN1 known ✓ Q05586 1/20 0.42
GRIN2A known ✓ Q12879 1/20 0.42
GRIN2B known ✓ Q13224 1/20 0.42
GRIN2C known ✓ Q14957 1/20 0.42
GRIN3A known ✓ Q8TCU5 1/20 0.42
LMNA P02545 8/20 0.65
KDM4E B2RXH2 5/20 0.65
CYP2D6 P10635 5/20 0.48

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
Cizolirtine SCHEMBL2791717 1.00 LMNA (0.65) LMNAKDM4ECYP2D6CHRM2SLC6A2
SCHEMBL5924572 0.87 LMNA (0.62) LMNAKDM4ECYP2D6CHRM2SLC6A2
Citric Acid SCHEMBL5185028 0.87 KDM4E (0.48) LMNAKDM4ECYP2D6SLC6A4SLC6A3
Diphenhydramine SCHEMBL322306 0.86 LMNA (0.80) LMNAKDM4ECYP2D6CHRM2SLC6A2
Cizolirtine SCHEMBL2776433 0.86 SLC6A2 (0.65) LMNAKDM4ECYP2D6CHRM2SLC6A2
Cizolirtine SCHEMBL290138 0.86 SLC6A2 (0.65) LMNAKDM4ECYP2D6CHRM2SLC6A2
Cizolirtine SCHEMBL5186750 0.86 SLC6A2 (0.65) LMNAKDM4ECYP2D6CHRM2SLC6A2
Citric Acid SCHEMBL4902057 0.85 LMNA (0.50) LMNAKDM4ECYP2D6CHRM2SLC6A2
Diphenhydramine SCHEMBL5678067 0.85 LMNA (0.79) LMNAKDM4ECYP2D6CHRM2SLC6A2
Diphenhydramine SCHEMBL7914760 0.85 LMNA (0.79) LMNAKDM4ECYP2D6CHRM2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200693-A1 Derivatives of Aryl (or Heteroaryl) Azolylcarbinols (in Particular Cizolirtin Citrate) for the Treatment of Opioid Addiction LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2008-08-21 US claimed
EP-1786419-A1 DERIVATIVES OF ARYL (OR HETEROARYL) AZOLYLCARBINOLS (IN PARTICULAR CIZOLIRTIN CITRATE) FOR THE TREATMENT OF OPIOID ADDICTION Laboratorios del Dr. Esteve S.A. (ES) 2007-05-23 EP claimed
EP-1786420-A1 DERIVATIVES OF ARYL (OR HETEROARYL) AZOLYLCARBINOLS FOR THE TREATMENT OF CENTRAL NEUROPATHIC PAIN Laboratorios del Dr. Esteve S.A. (ES) 2007-05-23 EP claimed
EP-1784178-A1 ARYL (OR HETEROARYL) AZOLYLCARBINOLS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-05-16 EP claimed
US-20070088024-A1 Active substance combination comprising a carbinol combined to at least an NSAID LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-04-19 US claimed
US-20070082893-A1 Active substance combination LABORATORIOS DEL DR. ESTEVE S.A (ES) 2007-04-12 US claimed
EP-1755678-A2 ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-02-28 EP claimed
EP-1746986-A1 ACTIVE SUBSTANCE COMBINATION COMPRISING A CARBINOL COMBINED TO AT LEAST AN NSAID LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-01-31 EP claimed
WO-2005097192-A9 ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID ESTEVE LABOR DR (ES) 2007-01-18 WO claimed
EP-1740174-A1 DERIVATIVES OF ARYL(OR HETEROARYL) AZOLYLCARBINOLS FOR THE TREATMENT OF ENURESIS Laboratorios del Dr. Esteve S.A. (ES) 2007-01-10 EP claimed
EP-1584335-A2 Active substance combination comprising a carbinol composition and an opioid LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2005-10-12 EP claimed
US-20050222136-A1 Active substance combination LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2005-10-06 US claimed
US-20050222135-A1 Active substance combination LABORATIONS DEL DR. ESTEVE S.A. (ES) 2005-10-06 US claimed
WO-2005067925-A1 DERIVATIVES OF ARYL(OR HETEROARYL) AZOLYLCARBINOLS FOR THE TREATMENT OF ENURESIS LABORATORIOS DR. ESTEVE S.A. (ES) 2005-07-28 WO claimed
US-20040142929-A1 Derivatives of aryl (or heteroaryl) azolylcarbinoles for the treatment of urinary incontinence LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2004-07-22 US claimed
EP-1103243-B1 UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES FOR THE TREATMENT OF TROUBLES MEDIATED BY AN EXCESS OF SUBSTANCE P ESTEVE LABOR DR (ES) 2004-01-07 EP claimed
EP-1086682-B1 UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES IN THE PREPARATION OF A MEDICAMENT FOR THE TREATMENT OF NEUROGENIC INFLAMMATION ESTEVE LABOR DR (ES) 2003-04-16 EP claimed
US-6518295-B1 Such as anxiety, depression, schizophrenia, manic depressive psychosis, sexual dysfunction, drug addiction, cognitive disorders, and locomotive disorders LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2003-02-11 US claimed
EP-1103243-A2 UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES IN THE PREPARATION OF A MEDICAMENT FOR THE TREATMENT OF TROUBLES MEDIATED BY AN EXCESS OF SUBSTANCE P LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2001-05-30 EP claimed
EP-1086682-A2 UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES IN THE PREPARATION OF A MEDICAMENT FOR THE TREATMENT OF NEUROGENIC INFLAMMATION LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2001-03-28 EP 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 (6 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-20050222135-A1 Active substance combination OPRM1, OPRK1, OPRL1 SLC6A2 140/4885OPRM1 1/4885HRH1 1541/4885
US-20040142929-A1 Derivatives of aryl (or heteroaryl) azolylcarbinoles for the treatment of urinary incontinence AADAC, AHR, ABAT SLC6A2 1099/4885OPRM1 494/4885HRH1 155/4885
US-20070088024-A1 Active substance combination comprising a carbinol combined to at least an NSAID PTGS1, PTGS2, PTGES2 SLC6A2 1741/4885OPRM1 133/4885HRH1 1125/4885
US-20080200693-A1 Derivatives of Aryl (or Heteroaryl) Azolylcarbinols (in Particular Cizolirtin Citrate) for the Treatment of Opioid Addiction CNR2, CNR1, HCRTR2 SLC6A2 299/4885OPRM1 7/4885HRH1 1336/4885
US-20050222136-A1 Active substance combination PTGS1, MMP8, TACR1 SLC6A2 690/4885OPRM1 122/4885HRH1 1155/4885
US-20070082893-A1 Active substance combination OPRM1, OPRK1, OPRL1 SLC6A2 140/4885OPRM1 1/4885HRH1 1541/4885

“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.