Canagliflozin Anhydrous

Canagliflozin Anhydrous

SCHEMBL322058

Cc1ccc(C2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc(-c2ccc(F)cc2)s1.Cc1ccc(C2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc(-c2ccc(F)cc2)s1.O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC5A2 known ✓ P31639 20/20 1.00
SLC5A1 P13866 6/20 0.98
ABCB11 O95342 1/20 0.98
ADORA3 P0DMS8 1/20 0.98
SLC6A4 P31645 1/20 0.98
SLC6A3 Q01959 1/20 0.98

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
Canagliflozin Anhydrous SCHEMBL23930431 1.00 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL681039 1.00 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL322059 1.00 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL28454075 1.00 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL29358577 1.00 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL19493519 0.99 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL19493514 0.99 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL15888791 0.99 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL16075101 0.99 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4
Canagliflozin Anhydrous SCHEMBL24037935 0.99 SLC5A2 (1.00) SLC5A2SLC5A1ABCB11ADORA3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015158839-A1 NOVEL CRYSTALLINE FORM OF 1-(BETA-D-GLUCOPYRANOSYL)-4-METHYL-3-[5-(4-FLUOROPHENYL)-2-THIENYLMETHYL]BENZENE LEK PHARMACEUTICALS D.D. (SI) 2015-10-22 WO disclosed
EP-2590631-A2 FORMULATION FOR CO-THERAPY TREATMENT OF DIABETES Janssen Pharmaceutica, N.V. (BE) 2013-05-15 EP disclosed
WO-2012006298-A2 FORMULATION FOR CO-THERAPY TREATMENT OF DIABETES JANSSEN PHARMACEUTICA NV (BE) 2012-01-12 WO disclosed