SCHEMBL24029863

SCHEMBL24029863

C#CCN(C)C(=O)CN(C)CCNC(=O)C(C)(C)NC(=O)COCc1ccc(Cc2ccccc2C)cc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL24029820 0.92 SLC5A1 (0.38) SLC5A1SLC5A2
SCHEMBL24029967 0.92 SLC5A1 (0.39) SLC5A1SLC5A2MAOAMAOB
SCHEMBL24029919 0.84 SLC5A1 (0.37) SLC5A1SLC5A2
SCHEMBL24029751 0.84 SLC5A1 (0.41) SLC5A1SLC5A2MAOAMAOB
SCHEMBL24029550 0.83 SLC5A1 (0.62) SLC5A1SLC5A2
SCHEMBL24029862 0.82 SLC5A1 (0.52) SLC5A1SLC5A2
SCHEMBL24897610 0.81 MAOB (0.37) MAOAMAOB
SCHEMBL24029745 0.77 SLC5A1 (0.52) SLC5A1SLC5A2MAOAMAOB
SCHEMBL24030017 0.77 LTA4H (0.41) SLC5A1SLC5A2MAOB
SCHEMBL24030100 0.77 SLC5A1 (0.50) SLC5A1SLC5A2MAOAMAOB

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