SCHEMBL9404170

SCHEMBL9404170

CCCCCCCCCC(=O)O[C@H]1[C@@H](OC)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 2/20 0.52
TLR4 O00206 5/20 0.51
LY96 Q9Y6Y9 5/20 0.49
TK2 O00142 2/20 0.48
PRKCA P17252 5/20 0.47

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
SCHEMBL8895219 1.00 LGALS8 (0.52) LGALS8TLR4LY96TK2PRKCA
SCHEMBL9846007 1.00 LGALS8 (0.52) LGALS8TLR4LY96TK2PRKCA
SCHEMBL4267305 1.00 LGALS8 (0.52) LGALS8TLR4LY96TK2PRKCA
SCHEMBL731630 1.00 LGALS8 (0.52) LGALS8TLR4LY96TK2PRKCA
SCHEMBL9404169 1.00 LGALS8 (0.52) LGALS8TLR4LY96TK2PRKCA
SCHEMBL11797892 0.93 TLR4 (0.56) LGALS8TLR4LY96
SCHEMBL19409216 0.92 LGALS8 (0.55) LGALS8TLR4LY96TK2PRKCA
SCHEMBL8194583 0.92 LGALS8 (0.55) LGALS8TLR4LY96TK2PRKCA
SCHEMBL15953245 0.92 LGALS8 (0.46) LGALS8TLR4LY96TK2
SCHEMBL9114830 0.90 TLR4 (0.54) TLR4LY96TK2PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0454772-B1 BLEACHING DETERGENT COMPOSITION NOVO NORDISK AS (DK) 1994-06-15 EP claimed
EP-0454772-B1 BLEACHING DETERGENT COMPOSITION NOVO NORDISK AS (DK) 1994-06-15 EP disclosed
EP-0454772-A1 BLEACHING DETERGENT COMPOSITION. NOVO NORDISK AS (DK) 1991-11-06 EP disclosed
EP-0380437-A2 Bleaching detergent composition NOVO NORDISK A/S (DK) 1990-08-01 EP disclosed
WO-1990008182-A1 BLEACHING DETERGENT COMPOSITION NOVO NORDISK A/S (DK) 1990-07-26 WO disclosed