SCHEMBL9347370

SCHEMBL9347370

CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 4/20 0.51
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LGALS8 O00214 2/20 0.43
LGALS3 P17931 2/20 0.43
LGALS4 P56470 2/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SELP P16109 2/20 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
SCHEMBL9342456 0.94 TLR4 (0.57) TLR4SELP
SCHEMBL9082185 0.93 TLR4 (0.52) TLR4ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL10385049 0.93 TLR4 (0.52) TLR4ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL4193269 0.91 TLR4 (0.49) TLR4ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL9342582 0.91 TLR4 (0.55) TLR4
SCHEMBL8216733 0.91 TLR4 (0.55) TLR4
SCHEMBL4193271 0.89 TLR4 (0.49) TLR4ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL9347376 0.89 TLR4 (0.49) TLR4ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL5436079 0.87 TLR4 (0.59) TLR4
SCHEMBL2196892 0.87 TLR4 (0.59) TLR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0225774-B1 Process for preparing derivatives of maltose HAYASHIBARA BIOCHEM LAB (JP) 1994-07-27 EP disclosed
EP-0225774-A2 Process for preparing derivatives of maltose KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 1987-06-16 EP disclosed