SCHEMBL20787407

SCHEMBL20787407

CN1CCN(C(=O)C(C)(C)NC(=O)COc2ccc(Cc3cc([C@H]4[C@H](O)[C@H](O)[C@H](O)C[SH]4C)ccc3Cl)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 18/20 0.67
SLC5A2 P31639 11/20 0.48

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
SCHEMBL20787144 0.87 SLC5A1 (0.62) SLC5A1SLC5A2
SCHEMBL20994697 0.84 SLC5A1 (0.67) SLC5A1SLC5A2
SCHEMBL20787353 0.84 SLC5A1 (0.61) SLC5A1SLC5A2
SCHEMBL20787121 0.82 SLC5A1 (0.65) SLC5A1SLC5A2
SCHEMBL20787207 0.80 SLC5A2 (0.57) SLC5A1SLC5A2
SCHEMBL20787405 0.80 SLC5A1 (1.00) SLC5A1SLC5A2
SCHEMBL20787215 0.80 SLC5A1 (0.52) SLC5A1SLC5A2
SCHEMBL22972815 0.79 SLC5A1 (0.66) SLC5A1SLC5A2
SCHEMBL20787203 0.79 SLC5A1 (0.52) SLC5A1SLC5A2
SCHEMBL20480891 0.79 SLC5A1 (0.62) SLC5A1SLC5A2

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
EP-3489226-B1 INHIBITORS OF SODIUM GLUCOSE COTRANSPORTER 1 LEXICON PHARMACEUTICALS INC (US) 2021-02-17 EP disclosed
EP-3489226-A1 INHIBITORS OF SODIUM GLUCOSE COTRANSPORTER 1 Lexicon Pharmaceuticals, Inc. (US) 2019-05-29 EP disclosed
EP-2925735-B1 INHIBITORS OF SODIUM GLUCOSE COTRANSPORTER 1 LEXICON PHARMACEUTICALS INC (US) 2019-03-13 EP disclosed