Tiagabine

Tiagabine

SCHEMBL3243472

CC#N.Cc1ccsc1C(=CCCN1CCC[C@@H](C(=O)O)C1)c1sccc1C.Cl

nearest known ligand 0.90

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 5)

geneUniProtsupporting neighboursconfidence
SLC6A1 known ✓ P30531 8/20 0.90
PTGS1 P23219 1/20 0.89
PDE4A P27815 1/20 0.89
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59

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 SCHEMBL1527642 0.96 SLC6A1 (0.98) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL5164417 0.95 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL7346237 0.95 SLC6A1 (0.98) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL18496408 0.95 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL41860 0.95 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL17493682 0.95 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL3272861 0.94 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL34653 0.94 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL342814 0.94 SLC6A1 (1.00) SLC6A1PTGS1PDE4AALDH1A1LMNA
Tiagabine SCHEMBL3958156 0.93 SLC6A1 (0.98) SLC6A1PTGS1PDE4AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070066656-A1 Novel stable polymorphic forms of an anticonvulsant SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2007-03-22 US claimed
WO-2005122698-A2 NOVEL STABLE POLYMORPHIC FORMS OF TIAGABINE HYDROCHLORIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2005-12-29 WO claimed
US-7667042-B2 Amorphous form of tiagabine hydrochloride; epilepsy SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2010-02-23 US disclosed
US-20070066656-A1 Novel stable polymorphic forms of an anticonvulsant SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2007-03-22 US disclosed
WO-2005122698-A2 NOVEL STABLE POLYMORPHIC FORMS OF TIAGABINE HYDROCHLORIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2005-12-29 WO disclosed