SCHEMBL6671603

SCHEMBL6671603

CCCCCCCCCCCC(=O)OC[C@H]1OCC(=O)[C@@H](O)[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 1/20 0.53
▸ DGKA P23743 1/20 0.43
▸ LPAR1 Q92633 3/20 0.43
▸ LPAR3 Q9UBY5 3/20 0.43
▸ ENPP2 Q13822 2/20 0.42
▸ PRKCA P17252 5/20 0.41

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
SCHEMBL6668049 1.00 NLRP3 (0.53) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL6667668 1.00 NLRP3 (0.53) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL6668026 0.85 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL6668206 0.85 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL6669114 0.85 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL15383902 0.79 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL17772837 0.79 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL12774857 0.79 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL15383903 0.79 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2
SCHEMBL19126951 0.79 NLRP3 (0.48) NLRP3DGKALPAR1LPAR3ENPP2

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
EP-1163248-B1 1,5-ANHYDRO-D-FRUCTOSE SUBSTITUTED WITH A HYDROPHOBIC GROUP FOR USE AS ANTI-OXIDANT AND/OR EMULSIFIER DANISCO (DK) 2004-09-22 — — EP disclosed
US-20020102342-A1 1,5-Anhydro-D-fructose substituted with a hydrophobic group for use as anti-oxidant and/or emulsifier DANISCO A/S (DK) 2002-08-01 — — US disclosed
EP-1163248-A1 1,5-ANHYDRO-D-FRUCTOSE SUBSTITUTED WITH A HYDROPHOBIC GROUP FOR USE AS ANTI-OXIDANT AND/OR EMULSIFIER DANISCO A/S (DK) 2001-12-19 — — EP disclosed
WO-2000056745-A1 1,5-ANHYDRO-D-FRUCTOSE SUBSTITUTED WITH A HYDROPHOBIC GROUP FOR USE AS ANTI-OXIDANT AND/OR EMULSIFIER DANISCO A/S (DK) 2000-09-28 — — WO disclosed
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