SCHEMBL28214428

SCHEMBL28214428

C[C@@H]1O[C@@](Cc2ccccc2)(OC(=N)C(Cl)(Cl)Cl)[C@@H](O)[C@H](O)[C@@H]1O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.30
SLC5A2 P31639 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
SCHEMBL8685792 0.84 SLC5A2 (0.33) SLC5A1SLC5A2
SCHEMBL8128971 0.84 SLC5A2 (0.33) SLC5A1SLC5A2
SCHEMBL8724852 0.70 SLC5A1 (0.36) SLC5A1SLC5A2
SCHEMBL8838823 0.70 SLC5A1 (0.36) SLC5A1SLC5A2
SCHEMBL8823097 0.67 SLC5A1 (0.36) SLC5A1SLC5A2
SCHEMBL8616794 0.67 SLC5A1 (0.39) SLC5A1SLC5A2
SCHEMBL4775193 0.66
SCHEMBL4574200 0.60 SLC5A2 (0.37) SLC5A1SLC5A2
SCHEMBL52407 0.59 ALDH1A1 (0.52)
SCHEMBL28379773 0.59 TRPA1 (0.43)

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
CN-105017341-B - half lactotetraose of sulphation rock algae and its preparation method and application 华东师范大学 2018-05-15 CN disclosed