SCHEMBL7459356

SCHEMBL7459356

CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](OS(=O)(=O)O)[C@@H]1OC(=O)CCCCCCCCCCCCC

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 19/20 0.62
▸ LY96 Q9Y6Y9 6/20 0.46

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
SCHEMBL6799052 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL7459349 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL7457803 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6799044 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6807587 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6807635 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6803158 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6802988 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6802998 1.00 TLR4 (0.62) TLR4LY96
SCHEMBL6800208 1.00 TLR4 (0.62) TLR4LY96

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-1095653-A9 GLUCOPYRANOSE DERIVATIVES AND PREVENTIVES AND/OR REMEDIES FOR HIV INFECTION CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-04-03 — — EP disclosed
EP-1095653-A1 GLUCOPYRANOSE DERIVATIVES AND PREVENTIVES AND/OR REMEDIES FOR HIV INFECTION CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-05-02 — — EP disclosed
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