Sumatriptan

Sumatriptan

SCHEMBL1503483

CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1.O=S(=O)(O)O

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HTR1BHTR1D

The experimentally established mechanism targets of Sumatriptan. 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
HTR1D known ✓ P28221 8/20 0.93
HTR1B known ✓ P28222 7/20 0.93
HTR1A P08908 13/20 0.93
HTR2C P28335 6/20 0.93
HTR2A P28223 4/20 0.93
HTR7 P34969 2/20 0.93
HTR5A P47898 2/20 0.93
HTR2B P41595 2/20 0.93
HTR1E P28566 1/20 0.93
HTR1F P30939 1/20 0.93
HTR3A P46098 1/20 0.93
SLC47A1 Q96FL8 1/20 0.93
HTR6 P50406 1/20 0.63
LMNA P02545 1/20 0.62
ADRA2B P18089 1/20 0.62
KCNH2 Q12809 1/20 0.62
SLC6A4 P31645 1/20 0.55
MPO P05164 1/20 0.52
KMT2A Q03164 1/20 0.52
ADRA1A P35348 1/20 0.52

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
Sumatriptan SCHEMBL29657591 1.00 HTR1A (0.93) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL183393 0.96 HTR1A (1.00) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL29450235 0.96 HTR1A (1.00) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL1482 0.96 HTR1A (1.00) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL4916383 0.95 HTR1A (0.98) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL1421675 0.95 HTR1A (0.98) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL6688549 0.93 HTR1A (0.89) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL6689001 0.92 HTR1A (0.87) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL41674 0.91 HTR1A (0.85) HTR1AHTR1DHTR1BHTR2CHTR2A
Sumatriptan SCHEMBL2404748 0.91 HTR1A (0.85) HTR1AHTR1DHTR1BHTR2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004076403-A1 SUMATRIPTAN CRYSTALLINE FORMS, PHARMACEUTICAL COMPOSITIONS AND METHODS TRANSFORM PHARMACEUTICALS, INC. (US) 2004-09-10 WO claimed
US-5554639-A 3-/2-/DIMETHYLAMINO/ETHYL/-N-METHYL-1H-INDOLE-5-METHANESULPHO NAMIDE SULFATE, INTRANASAL ADMINISTRATION FOR MIGRAINE GLAXO GROUP LIMITED (GB) 1996-09-10 US claimed
EP-0490689-B1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LTD (GB) 1995-03-15 EP claimed
WO-1992010477-A1 MEDICAMENTS GLAXO GROUP LIMITED (GB) 1992-06-25 WO claimed
EP-0490689-A1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LIMITED (GB) 1992-06-17 EP claimed
US-20230025210-A1 FORMULATIONS COMPRISING TRIPTAN COMPOUNDS TONIX MEDICINES, INC. 2023-01-26 US disclosed
US-11337962-B2 Formulations comprising triptan compounds UPSHER-SMITH LABORATORIES, LLC (US) 2022-05-24 US disclosed
US-11173209-B2 Compositions for drug administration AEGIS THERAPEUTICS, LLC (US) 2021-11-16 US disclosed
US-20200289467-A1 FORMULATIONS COMPRISING TRIPTAN COMPOUNDS TONIX MEDICINES, INC. 2020-09-17 US disclosed
US-20200138956-A1 COMPOSITIONS FOR DRUG ADMINISTRATION AEGIS THERAPEUTICS, LLC 2020-05-07 US disclosed
US-10603305-B2 Formulations comprising triptan compounds UPSHER-SMITH LABORATORIES, LLC (US) 2020-03-31 US disclosed
US-10576156-B2 Compositions for drug administration AEGIS THERAPEUTICS, LLC (US) 2020-03-03 US disclosed
CN-1030890-C Preparation method of pharmaceutical composition GLAXO GROUP LTD (GB) 1996-02-07 CN disclosed
EP-0490689-B1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LTD (GB) 1995-03-15 EP disclosed
EP-0490689-B1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LTD (GB) 1995-03-15 EP disclosed
WO-1992010477-A1 MEDICAMENTS GLAXO GROUP LIMITED (GB) 1992-06-25 WO disclosed
WO-1992010477-A1 MEDICAMENTS GLAXO GROUP LIMITED (GB) 1992-06-25 WO disclosed
EP-0490689-A1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LIMITED (GB) 1992-06-17 EP disclosed
EP-0490689-A1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LIMITED (GB) 1992-06-17 EP disclosed
EP-0490689-A1 3-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulphonamide sulphate (2:1) GLAXO GROUP LIMITED (GB) 1992-06-17 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 (7 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-11337962-B2 Formulations comprising triptan compounds SI, TPSD1, TPSB2 HTR1D 28/4885HTR1B 149/4885HTR1A 38/4885
US-11173209-B2 Compositions for drug administration SLC10A1, ABCB11, CSGALNACT1 HTR1D 4414/4885HTR1B 3113/4885HTR1A 3585/4885
US-20200138956-A1 COMPOSITIONS FOR DRUG ADMINISTRATION SLC10A1, ABCB11, CSGALNACT1 HTR1D 4414/4885HTR1B 3113/4885HTR1A 3585/4885
US-20200289467-A1 FORMULATIONS COMPRISING TRIPTAN COMPOUNDS SI, TPSD1, TPSB2 HTR1D 28/4885HTR1B 149/4885HTR1A 38/4885
US-20230025210-A1 FORMULATIONS COMPRISING TRIPTAN COMPOUNDS SI, TPSD1, TPSB2 HTR1D 28/4885HTR1B 149/4885HTR1A 38/4885
US-10576156-B2 Compositions for drug administration SLC10A1, ABCB11, CSGALNACT1 HTR1D 4414/4885HTR1B 3113/4885HTR1A 3585/4885
US-10603305-B2 Formulations comprising triptan compounds SI, TPSD1, TPSB2 HTR1D 28/4885HTR1B 149/4885HTR1A 38/4885

“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.