SCHEMBL3502893

SCHEMBL3502893

CCCCCO[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.56
SLC2A1 P11166 1/20 0.51
MAPK1 P28482 1/20 0.51
GJB2 P29033 1/20 0.44
LGALS8 O00214 1/20 0.44
LGALS3 P17931 1/20 0.44
LGALS4 P56470 1/20 0.44
ADORA2A P29274 2/20 0.40
ADORA2B P29275 2/20 0.40

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
SCHEMBL7696481 1.00 GBA1 (0.56) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL16395631 1.00 GBA1 (0.56) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL736485 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL8443464 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL9291634 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL23646744 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL4391706 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL1134708 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL258033 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8
SCHEMBL182764 0.98 GBA1 (0.59) GBA1SLC2A1MAPK1GJB2LGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110315930-A1 Compositions and methods for analyzing biomolecules using mass spectroscopy Life Technologies Corporation (US) 2011-12-29 US claimed
US-20100187475-A1 Compositions and Methods for Analyzing Biomolecules Using Mass Spectroscopy Life Technologies Corporation (US) 2010-07-29 US claimed
WO-2006047614-A2 COMPOSITIONS AND METHODS FOR ANALYZING BIOMOLECULES USING MASS SPECTROSCOPY INVITROGEN CORPORATION (US) 2006-05-04 WO claimed
US-20110315930-A1 Compositions and methods for analyzing biomolecules using mass spectroscopy Life Technologies Corporation (US) 2011-12-29 US disclosed
US-20100187475-A1 Compositions and Methods for Analyzing Biomolecules Using Mass Spectroscopy Life Technologies Corporation (US) 2010-07-29 US disclosed
US-20060214104-A1 Compositions and methods for analyzing biomolecules using mass spectroscopy INVITROGEN CORPORATION (US) 2006-09-28 US disclosed
WO-2006047614-A2 COMPOSITIONS AND METHODS FOR ANALYZING BIOMOLECULES USING MASS SPECTROSCOPY INVITROGEN CORPORATION (US) 2006-05-04 WO disclosed