SCHEMBL15445104

SCHEMBL15445104

CCCCOC1OC(CO)C(OCCCC)C(O)C1OCCCC

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GJB2 P29033 5/20 0.49
▸ MAPK1 P28482 1/20 0.48
▸ LGALS8 O00214 2/20 0.44
▸ LGALS3 P17931 2/20 0.44
▸ LGALS4 P56470 2/20 0.44
▸ GBA1 P04062 2/20 0.43
▸ SLC2A1 P11166 1/20 0.38
▸ TNF P01375 1/20 0.38

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
SCHEMBL14747620 0.92 MAPK1 (0.52) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL18733415 0.87 MAPK1 (0.48) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL5678760 0.87 MAPK1 (0.58) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL14413981 0.87 MAPK1 (0.51) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL17300176 0.87 MAPK1 (0.44) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL16079127 0.87 MAPK1 (0.44) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL18733215 0.87 MAPK1 (0.44) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL12819629 0.87 MAPK1 (0.44) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL15508089 0.87 MAPK1 (0.44) GJB2MAPK1LGALS8LGALS3LGALS4
SCHEMBL18733408 0.87 MAPK1 (0.44) GJB2MAPK1LGALS8LGALS3LGALS4

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-8637578-B2 Reagents and methods for the formation of disulfide bonds and the glycosylation of proteins ISIS INNOVATION LIMITED (GB) 2014-01-28 — — US disclosed
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