SCHEMBL546864

SCHEMBL546864

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

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.60
▸ GBA1 P04062 3/20 0.54
▸ LGALS8 O00214 1/20 0.52
▸ LGALS3 P17931 1/20 0.52
▸ LGALS4 P56470 1/20 0.52
▸ GJB2 P29033 1/20 0.48
▸ SLC2A1 P11166 1/20 0.43
▸ TNF P01375 1/20 0.43

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
SCHEMBL8370478 0.96 MAPK1 (0.60) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL8370481 0.96 MAPK1 (0.60) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL5678760 0.95 MAPK1 (0.58) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL25414516 0.94 MAPK1 (0.60) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL25415166 0.94 MAPK1 (0.60) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL25415432 0.94 MAPK1 (0.60) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL14747620 0.90 MAPK1 (0.52) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL21080979 0.90 MAPK1 (0.54) MAPK1GBA1LGALS8LGALS3LGALS4
SCHEMBL16678936 0.89 MAPK1 (0.64) MAPK1LGALS8LGALS3LGALS4GJB2
SCHEMBL14691296 0.89 MAPK1 (0.64) MAPK1LGALS8LGALS3LGALS4GJB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110722-B2 Aromatic acyltransferase genes LOCAL INDEPENDENT ADMINISTRATIVE INSTITUTION AOMORI PREFECTURAL INDUSTRIAL TECHNOLOGY RESEARCH CENTER (JP) 2012-02-07 — — US disclosed
EP-1947179-B1 NOVEL AROMATIC ACYL GROUP TRANSFERASE GENES LOCAL INDEPENDENT ADMINISTRATIVE INSTITUTION AOMORI PREFECTURAL IND TECHNOLOGY RES CT (JP) 2011-09-21 — — EP disclosed
US-20090288225-A1 Novel Aromatic Acyltransferase Genes AOMORI PREFECTURE (JP) 2009-11-19 — — US disclosed
EP-1947179-A1 NOVEL AROMATIC ACYL GROUP TRANSFERASE GENE Aomori prefecture (JP) 2008-07-23 — — EP disclosed
Send feedback