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Sugi Predict / Compounds / SCHEMBL20994697

SCHEMBL20994697

SCHEMBL20994697

Cc1ccc([C@@H]2[C@H](O)[C@H](O)[C@@H](O)C[SH]2C)cc1Cc1ccc(OCCCC(=O)NC(C)(C)C(=O)N2CCN(C)CC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 19/20 0.67
▸ SLC5A2 P31639 11/20 0.67

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
SCHEMBL20787319 0.92 SLC5A1 (0.58) SLC5A1SLC5A2
SCHEMBL20787352 0.92 SLC5A1 (0.59) SLC5A1SLC5A2
SCHEMBL22972815 0.91 SLC5A1 (0.66) SLC5A1SLC5A2
SCHEMBL20787371 0.91 SLC5A1 (0.56) SLC5A1SLC5A2
SCHEMBL20787347 0.91 SLC5A1 (0.63) SLC5A1SLC5A2
SCHEMBL20787102 0.88 SLC5A1 (0.51) SLC5A1SLC5A2
SCHEMBL20787248 0.88 SLC5A1 (0.54) SLC5A1SLC5A2
SCHEMBL20787098 0.87 SLC5A1 (0.64) SLC5A1SLC5A2
SCHEMBL20787267 0.85 SLC5A1 (0.60) SLC5A1SLC5A2
SCHEMBL20787320 0.85 SLC5A1 (0.52) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3489226-A1 INHIBITORS OF SODIUM GLUCOSE COTRANSPORTER 1 Lexicon Pharmaceuticals, Inc. (US) 2019-05-29 — — EP disclosed