Eletriptan

Eletriptan

SCHEMBL2146547

Br.CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12.O

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HTR1BHTR1DHTR1F

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

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1B known ✓ P28222 7/20 0.96
HTR1D known ✓ P28221 6/20 0.64
HTR1F known ✓ P30939 2/20 0.56
HTR1A P08908 3/20 0.96
CHRM2 P08172 1/20 0.96
ADRA2A P08913 1/20 0.96
CHRM1 P11229 1/20 0.96
DRD1 P21728 1/20 0.96
SLC6A2 P23975 1/20 0.96
OPRM1 P35372 1/20 0.96
SLC6A3 Q01959 1/20 0.96
HRH3 Q9Y5N1 1/20 0.96
HTR6 P50406 15/20 0.65
HTR2A P28223 2/20 0.56
HTR2C P28335 2/20 0.56
HTR7 P34969 2/20 0.56
DRD3 P35462 1/20 0.56

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
Eletriptan SCHEMBL4431798 0.99 HTR1B (0.98) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL4233264 0.99 HTR1B (0.98) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL29984875 0.99 HTR1B (0.98) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL3713443 0.99 HTR1B (0.98) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL317370 0.99 HTR1B (0.98) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL798473 0.98 HTR1B (1.00) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL29414096 0.98 HTR1B (1.00) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL10083479 0.98 HTR1B (1.00) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL1556539 0.98 HTR1B (1.00) HTR1BHTR1ACHRM2ADRA2ACHRM1
Eletriptan SCHEMBL26719 0.98 HTR1B (1.00) HTR1BHTR1ACHRM2ADRA2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754239-B2 Process for preparing eletriptan hydrobromide having α-form SMS PHARMACEUTICALS LIMITED (IN) 2014-06-17 US claimed
WO-2014063752-A1 PROCESS FOR MAKING CRYSTALLINE FORM ALPHA OF ELETRIPTAN HYDROBROMIDE SYNTHON BV (NL) 2014-05-01 WO claimed
US-20130023672-A1 PROCESS FOR PREPARING ELETRIPTAN HYDROBROMIDE HAVING a-FORM VENTURI SRINIVASA RAO (IN) 2013-01-24 US claimed
WO-2011089614-A1 PROCESS FOR PREPARING ELETRIPTAN HYDROBROMIDE HAVING α-FORM SMS PHARMACEUTICALS LIMITED (IN) 2011-07-28 WO claimed
US-7238723-B2 Indole derivatives PFIZER INC. (US) 2007-07-03 US claimed
JP-3777094-B2 2006-05-24 JP claimed
US-20050131237-A1 Indole derivatives PFIZER INC. 2005-06-16 US claimed
EP-1135381-B1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE PFIZER LTD (GB) 2004-08-11 EP claimed
CN-1131860-C eletriptan hydrobromide monohydrate PFIZER INC. (US) 2003-12-24 CN claimed
US-20020013358-A1 For therapy of migraine, recurrent migraine, hypertension, depression, emesis, anxiety, an eating disorder, obesity, drug abuse, cluster headache, pain, chronic paroxysmal hemicrania and headache PFIZER INC. 2002-01-31 US claimed
CN-1328554-A Eletriptan hydrobromide monohydrate PFIZER LTD (US) 2001-12-26 CN claimed
EP-1135381-A1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE Pfizer Limited (GB) 2001-09-26 EP claimed
WO-2000032589-A1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE PFIZER LIMITED (GB) 2000-06-08 WO claimed
WO-2017125351-A1 PROCESS FOR PREPARING (( R)-3-[(-1-METHYLPYRROLIDIN-2-YL)METHYL]-5-(2-PHENYLSULFONYLETHYL)-1H-INDOLE LABORATORIOS LESVI SL (ES) 2017-07-27 WO disclosed
CN-104292217-A Preparation method and purification method of alpha crystal form eletriptan hydrobromide SHANGHAI INST PHARM INDUSTRY 2015-01-21 CN disclosed
US-8754239-B2 Process for preparing eletriptan hydrobromide having α-form SMS PHARMACEUTICALS LIMITED (IN) 2014-06-17 US disclosed
EP-1135381-A1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE Pfizer Limited (GB) 2001-09-26 EP disclosed
EP-1135381-A1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE Pfizer Limited (GB) 2001-09-26 EP disclosed
WO-2000032589-A1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE PFIZER LIMITED (GB) 2000-06-08 WO disclosed
WO-2000032589-A1 ELETRIPTAN HYDROBROMIDE MONOHYDRATE PFIZER LIMITED (GB) 2000-06-08 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 (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-20020013358-A1 For therapy of migraine, recurrent migraine, hypertension, depression, emesis, anxiety, an eating disorder, obesity, drug abuse, cluster headache, pain, chronic paroxysmal hemicrania and headache HTR2B, HTR4, HTR1A HTR1B 5/4885HTR1D 13/4885HTR1F 28/4885
US-20130023672-A1 PROCESS FOR PREPARING ELETRIPTAN HYDROBROMIDE HAVING a-FORM TPSB2, TPSAB1, TPH1 HTR1B 33/4885HTR1D 16/4885HTR1F 27/4885
US-20050131237-A1 Indole derivatives TPH1, TPH2, HTR3A HTR1B 23/4885HTR1D 19/4885HTR1F 31/4885

“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.