SCHEMBL20787374

SCHEMBL20787374

Cc1ccc([C@H]2[C@H](O)[C@H](O)[C@H](O)C[SH]2C)cc1Cc1ccc(CCCC(=O)NCC(C)(C)C(=O)N(C)CCN(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 9/20 0.66
SLC5A1 P13866 18/20 0.53

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
SCHEMBL20787148 0.90 SLC5A1 (0.64) SLC5A2SLC5A1
SCHEMBL20994693 0.88 SLC5A1 (0.62) SLC5A2SLC5A1
SCHEMBL20787329 0.85 SLC5A1 (0.51) SLC5A2SLC5A1
SCHEMBL20480817 0.83 SLC5A1 (0.65) SLC5A2SLC5A1
SCHEMBL20787240 0.83 SLC5A1 (0.66) SLC5A2SLC5A1
SCHEMBL22972814 0.82 SLC5A1 (0.51) SLC5A2SLC5A1
SCHEMBL20787159 0.82 SLC5A1 (0.66) SLC5A2SLC5A1
SCHEMBL20787237 0.81 SLC5A1 (0.67) SLC5A2SLC5A1
SCHEMBL20787369 0.80 SLC5A1 (0.57) SLC5A2SLC5A1
SCHEMBL20787271 0.80 SLC5A1 (0.61) SLC5A2SLC5A1

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