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Sugi Predict / Compounds / SCHEMBL20787341

SCHEMBL20787341

SCHEMBL20787341

CS[C@H]1OC(c2ccc(C)c(Cc3ccc(CCCCNCC(C)(C)C(N)=O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 19/20 1.00
▸ SLC5A2 P31639 3/20 1.00

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
SCHEMBL15748772 1.00 SLC5A1 (1.00) SLC5A1SLC5A2
SCHEMBL20787360 0.90 SLC5A1 (0.82) SLC5A1SLC5A2
SCHEMBL15748707 0.90 SLC5A1 (0.82) SLC5A1SLC5A2
SCHEMBL19034509 0.87 SLC5A1 (0.84) SLC5A1SLC5A2
SCHEMBL20787168 0.87 SLC5A1 (0.98) SLC5A1SLC5A2
SCHEMBL20787162 0.87 SLC5A1 (0.81) SLC5A1SLC5A2
SCHEMBL15748765 0.86 SLC5A1 (1.00) SLC5A1SLC5A2
SCHEMBL20787099 0.86 SLC5A1 (0.83) SLC5A1SLC5A2
SCHEMBL15748740 0.85 SLC5A1 (0.79) SLC5A1SLC5A2
SCHEMBL16163020 0.85 SLC5A1 (0.79) 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