SCHEMBL14747620

SCHEMBL14747620

CCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1OCCCC

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.52
▸ SLC2A1 P11166 1/20 0.46
▸ LGALS8 O00214 2/20 0.45
▸ LGALS3 P17931 1/20 0.45
▸ LGALS4 P56470 1/20 0.45
▸ GBA1 P04062 1/20 0.44
▸ GJB2 P29033 1/20 0.42
▸ TNF P01375 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TYR P14679 1/20 0.39

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
SCHEMBL5678760 0.95 MAPK1 (0.58) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL14413981 0.95 MAPK1 (0.51) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL25415432 0.94 MAPK1 (0.60) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL25415166 0.94 MAPK1 (0.60) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL25414516 0.94 MAPK1 (0.60) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL15445104 0.92 GJB2 (0.49) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL14747649 0.90 TNF (0.51) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL16414481 0.90 TNF (0.51) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL546864 0.90 MAPK1 (0.60) MAPK1SLC2A1LGALS8LGALS3LGALS4
SCHEMBL25417760 0.87 MAPK1 (0.54) MAPK1SLC2A1LGALS8LGALS3LGALS4

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
US-8389565-B2 Antidiabetic agents; controlling carbohydrate metabolism SIMON FRASER UNIVERSITY (CA) 2013-03-05 — — US disclosed
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