Granisetron

Granisetron

SCHEMBL445223

CN1C2CCCC1CC(NC(=O)c1nn(C)c3ccccc13)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HTR3A

The experimentally established mechanism targets of Granisetron. 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
HTR3A known ✓ P46098 12/20 1.00
HTR3E A5X5Y0 1/20 1.00
SLC22A2 O15244 1/20 1.00
HTR3B O95264 1/20 1.00
CHRNB2 P17787 1/20 1.00
CHRNA3 P32297 1/20 1.00
CHRNA4 P43681 1/20 1.00
KCNH2 Q12809 1/20 1.00
HTR3D Q70Z44 1/20 1.00
HTR3C Q8WXA8 1/20 1.00
SLC47A1 Q96FL8 1/20 1.00
ALDH1A1 P00352 1/20 0.91
CYP3A4 P08684 1/20 0.91
TSHR P16473 1/20 0.91
MAPK1 P28482 1/20 0.91
HSD17B10 Q99714 1/20 0.91
KDM4E B2RXH2 1/20 0.80

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
Granisetron SCHEMBL4891 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL29372622 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL13660190 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL30372601 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL4109977 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL13287290 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL16642163 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL34178 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL4890 1.00 HTR3A (1.00) HTR3AHTR3ESLC22A2HTR3BCHRNB2
Granisetron SCHEMBL33433 0.99 HTR3A (0.98) HTR3AHTR3ESLC22A2HTR3BCHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040029972-A1 Combination treatment for depression HOWARD HARRY R (US) 2004-02-12 US claimed
EP-1230921-A1 Combination treatment for depression Pfizer Products Inc. (US) 2002-08-14 EP claimed
US-20020107244-A1 An antidepressant formulation consists of a biphenoxy or binaphthelenoxy compound as antidepressant, a 5-HT3 receptor antagonist and a carrier PFIZER PRODUCTS INC. 2002-08-08 US claimed
US-20020035057-A1 Treatment of movement disorders by administration of 5-hydroxytryptamine receptor/alpha2 adrenergic receptor antagonist compositions RICHTER VIRGINIA PACT (US) 2002-03-21 US claimed
EP-0323105-B1 Process for the preparation of 3-methylindazole-3-carboxylic acid BEECHAM GROUP PLC (GB) 1999-10-20 EP claimed
EP-0559297-B1 Use of heterocyclic derivatives for the manufacture of medicaments GLAXO GROUP LTD (GB) 1997-05-07 EP claimed
US-5530008-A USEFUL FOR TREATING ANXIETY DISORDER AND AGORAPHOBIA SANDOZ LTD. (CH) 1996-06-25 US claimed
EP-0279512-B1 Use of certain 5-HT3 receptor antagonists in the treatment of visceral pain BEECHAM GROUP PLC (GB) 1996-03-27 EP claimed
EP-0279114-B2 Medicaments for the treatment or prevention of the withdrawal syndrome GLAXO GROUP LTD (GB) 1995-08-23 EP claimed
EP-0422154-B1 THERAPEUTIC USE OF 5-HT3 RECEPTOR ANTAGONISTS SANDOZ AG (AT) 1993-12-01 EP claimed
US-4859709-A Pharmaceutical composition BEECHAM GROUP PLC (GB) 1989-08-22 US claimed
EP-0323105-A1 Novel process BEECHAM GROUP PLC (GB) 1989-07-05 EP claimed
US-4845092-A OF VISCERAL PAIN IN MAMMALS, HUMANS BEECHAM GROUP PLC (GB) 1989-07-04 US claimed
EP-0279990-A2 Use of heterocyclic derivatives in the treatment of cognitive disorders GLAXO GROUP LIMITED (GB) 1988-08-31 EP claimed
EP-0279512-A2 Use of certain 5-HT3 receptor antagonists in the treatment of visceral pain BEECHAM GROUP PLC (GB) 1988-08-24 EP claimed
EP-0279114-A1 Medicaments for the treatment or prevention of the withdrawal syndrome GLAXO GROUP LIMITED (GB) 1988-08-24 EP claimed
EP-0278173-A2 Use of heterocyclic derivatives in the treatment of depressions GLAXO GROUP LIMITED (GB) 1988-08-17 EP claimed
WO-1988003801-A1 MEDICAMENTS FOR TREATMENT OR PREVENTION OF WITHDRAWAL SYNDROME GLAXO GROUP LIMITED (GB) 1988-06-02 WO claimed
EP-0223385-A2 8-Azabicyclo[3,2,1]octane and 9-azabicyclo[3,3,1]nonane derivatives BEECHAM GROUP PLC (GB) 1987-05-27 EP claimed
EP-0200444-A2 Azabicyclononyl-indazole-carboxamide having 5-HT antagonist activity BEECHAM GROUP PLC (GB) 1986-11-05 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 (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-20020107244-A1 An antidepressant formulation consists of a biphenoxy or binaphthelenoxy compound as antidepressant, a 5-HT3 receptor antagonist and a carrier HTR3A, HTR3E, HTR4 HTR3A 1/4885HTR3E 2/4885SLC22A2 814/4885
US-20040029972-A1 Combination treatment for depression HTR3A, HTR5A, HTR6 HTR3A 1/4885HTR3E 7/4885SLC22A2 890/4885
US-20020035057-A1 Treatment of movement disorders by administration of 5-hydroxytryptamine receptor/alpha2 adrenergic receptor antagonist compositions HTR2C, HTR2A, ADRA2C HTR3A 8/4885HTR3E 28/4885SLC22A2 692/4885

“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.