SCHEMBL24029916

SCHEMBL24029916

C#CCN(C)C(=O)CN(C)CCNC(=O)C(C)(C)NC(=O)C/C=C/c1ccc(Cc2cc([C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 18/20 0.45
SLC5A2 P31639 10/20 0.45

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
SCHEMBL24029938 0.94 SLC5A1 (0.48) SLC5A1SLC5A2
SCHEMBL24029908 0.89 SLC5A1 (0.60) SLC5A1SLC5A2
SCHEMBL26556681 0.88 SLC5A1 (0.59) SLC5A1SLC5A2
SCHEMBL26552664 0.88 SLC5A1 (0.51) SLC5A1SLC5A2
SCHEMBL24038301 0.86 SLC5A1 (0.43) SLC5A1SLC5A2
SCHEMBL24029919 0.85 SLC5A1 (0.37) SLC5A1SLC5A2
SCHEMBL26806168 0.82 SLC5A1 (0.64) SLC5A1SLC5A2
SCHEMBL24029814 0.81 SLC5A1 (0.54) SLC5A1SLC5A2
SCHEMBL24029978 0.81 SLC5A1 (0.63) SLC5A1SLC5A2
SCHEMBL24029825 0.81 SLC5A1 (0.61) 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
WO-2021227440-A1 A CLASS OF ARYL GLUCOSIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海喆邺生物科技有限公司 2021-11-18 WO disclosed