Tiagabine

Tiagabine

SCHEMBL3272861

Cc1ccsc1C(=CCCN1CCC[C@H](C(=O)O)C1)c1sccc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A1

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

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A1 known ✓ P30531 10/20 1.00
PTGS1 P23219 1/20 1.00
PDE4A P27815 1/20 1.00
CYP1A2 P05177 1/20 0.64
CYP2D6 P10635 1/20 0.64
CYP2C9 P11712 1/20 0.64
TSHR P16473 1/20 0.64
NFKB1 P19838 1/20 0.64
CYP2C19 P33261 1/20 0.64
HSD17B10 Q99714 1/20 0.64
ALDH1A1 P00352 1/20 0.64
LMNA P02545 1/20 0.64

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
Tiagabine SCHEMBL342814 1.00 SLC6A1 (1.00) SLC6A1PTGS1PDE4ACYP1A2CYP2D6
Tiagabine SCHEMBL34653 1.00 SLC6A1 (1.00) SLC6A1PTGS1PDE4ACYP1A2CYP2D6
Tiagabine SCHEMBL41860 0.99 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL18496408 0.99 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL7346237 0.99 SLC6A1 (0.98) SLC6A1PTGS1PDE4ACYP1A2CYP2D6
Tiagabine SCHEMBL3958156 0.99 SLC6A1 (0.98) SLC6A1PTGS1PDE4ACYP1A2CYP2D6
Tiagabine SCHEMBL17493682 0.99 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL5164417 0.99 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL1527642 0.98 SLC6A1 (0.98) SLC6A1PTGS1PDE4AALDH1A1LMNA
SCHEMBL9773551 0.95 SLC6A1 (0.90) SLC6A1PTGS1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9649297-B2 Treatment of ADHD GOSFORTH CENTRE (HOLDINGS) PTY LTD. (AU) 2017-05-16 US disclosed
US-20150313877-A1 TREATMENT OF ADHD GOSFORTH CT HOLDINGS PTY LTD (AU) 2015-11-05 US disclosed
US-8957099-B2 Treatment of ADHD GOSFORTH CENTRE (HOLDINGS) PTY LTD. (AU) 2015-02-17 US disclosed
WO-2013074320-A1 ALPHA-2B RECEPTOR AGONIST AND ANTICONVULSANT COMPOSITIONS FOR TREATING CHRONIC PAIN ALLERGAN, INC. (US) 2013-05-23 WO disclosed
US-8394813-B2 Active agent delivery systems and methods for protecting and administering active agents SHIRE LLC (US) 2013-03-12 US disclosed
EP-2505197-A1 Treatment of ADHD Gosforth Centre (Holdings) Pty Ltd (AU) 2012-10-03 EP disclosed
US-20100087422-A1 TREATMENT OF ADHD GOSFORTH CENTRE (HOLDINGS) PTY LTD (AU) 2010-04-08 US disclosed
US-20090306228-A1 ACTIVE AGENT DELIVERY SYSTEMS AND METHODS FOR PROTECTING AND ADMINISTERING ACTIVE AGENTS SHIRE LLC (US) 2009-12-10 US disclosed
WO-2009124755-A1 COMPOUNDS WITH NOVEL MEDICAL USES AND METHOD OF IDENTIFYING SUCH COMPOUNDS EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2009-10-15 WO disclosed
US-20090253792-A1 ACTIVE AGENT DELIVERY SYSTEMS AND METHODS FOR PROTECTING AND ADMINISTERING ACTIVE AGENTS SHIRE LLC (US) 2009-10-08 US disclosed
US-7427600-B2 Active agent delivery systems and methods for protecting and administering active agents SHIRE LLC (US) 2008-09-23 US disclosed
WO-2008079727-A2 COMPOSITIONS COMPRISING AN PAN-ALPHA-2 RECEPTOR AGONIST AND AN ANTICONVULSANT FOR TREATING CHRONIC PAIN ALLERGAN, INC. (US) 2008-07-03 WO disclosed
US-20070232529-A1 mesalamine covalently attached to carrier peptide at C-terminus, interspersed and/or side chain; releasing into bloodstream; reducing dosage NEW RIVER PHARMACEUTICALS INC. (US) 2007-10-04 US disclosed
WO-2005092886-A1 PROCESS FOR THE PREPARATION OF AMORPHOUS FORM OF TIAGABINE RANBAXY LABORATORIES LIMITED (IN) 2005-10-06 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-20090253792-A1 ACTIVE AGENT DELIVERY SYSTEMS AND METHODS FOR PROTECTING AND ADMINISTERING ACTIVE AGENTS HDGF, CTSA, IAPP SLC6A1 1403/4885PTGS1 1133/4885PDE4A 2900/4885
US-20090306228-A1 ACTIVE AGENT DELIVERY SYSTEMS AND METHODS FOR PROTECTING AND ADMINISTERING ACTIVE AGENTS HDGF, CTSA, IAPP SLC6A1 1403/4885PTGS1 1133/4885PDE4A 2900/4885
US-20070232529-A1 mesalamine covalently attached to carrier peptide at C-terminus, interspersed and/or side chain; releasing into bloodstream; reducing dosage VIP, BST2, FCGR3B SLC6A1 1250/4885PTGS1 521/4885PDE4A 1348/4885

“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.