Zolmitriptan

Zolmitriptan

SCHEMBL1770027

CN(C)CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12.O=C(O)CCC(=O)O

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HTR1BHTR1D

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

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1D known ✓ P28221 12/20 0.87
HTR1B known ✓ P28222 11/20 0.87
HTR1A P08908 9/20 0.87
HTR2A P28223 6/20 0.87
KMT2A Q03164 2/20 0.87
ADRA1A P35348 1/20 0.87
HTR1F P30939 2/20 0.56
SCN9A Q15858 1/20 0.51
HTR2B P41595 2/20 0.48
HTR2C P28335 2/20 0.48
HTR1E P28566 1/20 0.48
HTR7 P34969 1/20 0.48
HTR3A P46098 1/20 0.48
HTR5A P47898 1/20 0.48
SLC47A1 Q96FL8 1/20 0.48
LMNA P02545 1/20 0.48
ADRA2B P18089 1/20 0.48
KCNH2 Q12809 1/20 0.48
SLC6A4 P31645 1/20 0.46

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
Zolmitriptan SCHEMBL2323472 0.94 HTR1D (0.85) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL5085492 0.94 HTR1D (0.89) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL4427888 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL14861150 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL29835946 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL33336 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL40595 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL29356689 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL1246512 0.93 HTR1D (1.00) HTR1DHTR1BHTR1AHTR2AKMT2A
Zolmitriptan SCHEMBL2458156 0.92 HTR1D (0.98) HTR1DHTR1BHTR1AHTR2AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110112157-A1 PROCESS FOR THE PREPARATION OF ZOLMITRIPTAN, SALTS AND SOLVATES THEREOF GENERICS [UK] LIMITED (GB) 2011-05-12 US disclosed
CN-101883766-A Process for the preparation of zolmitriptan, salts and solvates thereof GENERICS UK LTD 2010-11-10 CN disclosed
EP-2201003-A1 PROCESS FOR THE PREPARATION OF ZOLMITRIPTAN, SALTS AND SOLVATES THEREOF Generics Ýuk¨Limited (GB) 2010-06-30 EP disclosed
WO-2009044211-A1 PROCESS FOR THE PREPARATION OF ZOLMITRIPTAN, SALTS AND SOLVATES THEREOF GENERICS [UK] LIMITED (GB) 2009-04-09 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-20110112157-A1 PROCESS FOR THE PREPARATION OF ZOLMITRIPTAN, SALTS AND SOLVATES THEREOF LPXN, LIPA, NPSR1 HTR1D 30/4885HTR1B 105/4885HTR1A 27/4885

“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.