SCHEMBL16827171

SCHEMBL16827171

CCCCCCCCCCCCCCCCN([C@]1(O)C[C@@H](O)[C@H](O)[C@@H](CO)O1)[C@]1(O)C[C@@H](O)[C@H](O)[C@@H](CO)O1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 9/20 0.34
▸ GBA2 Q9HCG7 11/20 0.32
▸ GAA P10253 2/20 0.32
▸ MGAM O43451 2/20 0.32
▸ UGCG Q16739 1/20 0.32

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
SCHEMBL15072484 0.69 EPHX2 (0.47) GBA1
SCHEMBL19519584 0.68 GBA1 (0.33) GBA1
SCHEMBL20624274 0.68 GBA1 (0.33) GBA1
SCHEMBL8350328 0.63 PYGB (0.32) —
SCHEMBL25366499 0.63 GAA (0.37) GAA
SCHEMBL5551957 0.63 GAA (0.37) GAA
SCHEMBL22409570 0.63 GAA (0.37) GAA
SCHEMBL19326781 0.63 GAA (0.37) GAA
SCHEMBL9699515 0.63 GAA (0.37) GAA
SCHEMBL19326770 0.63 GAA (0.37) GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083658-A2 METHODS AND ASSAYS RELATING TO CIRCULATING TUMOR CELLS President and Fellows of Harvard College (US) 2016-10-26 — — EP disclosed
WO-2015095604-A2 METHODS AND ASSAYS RELATING TO CIRCULATING TUMOR CELLS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-06-25 — — WO disclosed
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