SCHEMBL20220910

SCHEMBL20220910

OCC1O[C@H](c2cccc(CCCCc3cccc([C@H]4OC(CO)[C@@H](O)C(O)C4O)c3)c2)C(O)C(O)[C@@H]1O

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 20/20 0.87

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
SCHEMBL20121212 1.00 SLC5A2 (0.87) SLC5A2
SCHEMBL15820688 1.00 SLC5A2 (0.87) SLC5A2
SCHEMBL15820690 1.00 SLC5A2 (0.87) SLC5A2
SCHEMBL15272511 0.93 SLC5A2 (1.00) SLC5A2
SCHEMBL15272512 0.93 SLC5A2 (1.00) SLC5A2
SCHEMBL15270405 0.90 SLC5A2 (1.00) SLC5A2
SCHEMBL15820460 0.89 SLC5A2 (0.78) SLC5A2
SCHEMBL18058584 0.89 SLC5A2 (0.78) SLC5A2
SCHEMBL15820463 0.89 SLC5A2 (0.78) SLC5A2
SCHEMBL15270206 0.88 SLC5A2 (0.77) SLC5A2

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-2935302-B1 MANNOSE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS VERTEX PHARMA (US) 2018-06-06 EP disclosed